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Article: Synthesis of anthraquinone-connected coumarin derivatives via grindstone method and their evaluation of antibacterial, antioxidant, tyrosinase inhibitory activities with molecular docking, and DFT calculation studies.

Loganathan, Velmurugan / Ahamed, Anis / Radhakrishnan, Surendrakumar / Z Gaafar, Abdel-Rhman / Gurusamy, Raman / Akbar, Idhayadhulla

Heliyon

2024 Volume 10, Issue 3, Page(s) e25168

Abstract: Anthraquinones and coumarins have excellent pharmacological activities and are an important class of natural plant metabolites with various biological activities. In this study, anthraquinone-9,10-dione and coumarin derivatives were combined to develop a ...

Abstract	Anthraquinones and coumarins have excellent pharmacological activities and are an important class of natural plant metabolites with various biological activities. In this study, anthraquinone-9,10-dione and coumarin derivatives were combined to develop a novel anthraquinone-connected coumarin-derivative sequence. The synthesised novel anthraquinone-connected coumarin derivatives (
Language	English
Publishing date	2024-01-29
Publishing country	England
Document type	Journal Article
ZDB-ID	2835763-2
ISSN	2405-8440
ISSN	2405-8440
DOI	10.1016/j.heliyon.2024.e25168
Database	MEDical Literature Analysis and Retrieval System OnLINE

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Article ; Online: Antimicrobial and cytotoxic activities of novel pyrimidine-2,4-dione connected with 2H-thiopyran derivatives

Anis Ahamed / Ibrahim A. Arif / Radhakrishnan SurendraKumar / Idhayadhulla Akbar / Baji Shaik

Journal of King Saud University: Science, Vol 35, Iss 4, Pp 102588- (2023)

2023

Abstract: Objectives: The purpose of this study is to develop a new pyrimidine-2,4-dione hybrid with 2H-thiopyran molecules as a potential antibacterial and antifungal agents against clinical pathogens that cause infectious diseases, in addition to conducting the ... ...

Abstract	Objectives: The purpose of this study is to develop a new pyrimidine-2,4-dione hybrid with 2H-thiopyran molecules as a potential antibacterial and antifungal agents against clinical pathogens that cause infectious diseases, in addition to conducting the cytotoxic screening. Methods: The synthesis of 2H-thiopyran connecting pyrimidine-2,4-dionederivatives was carried out in a medium consisting of water with an Mg(II) acetate catalyst. The antimicrobial activity of all synthesized compounds was tested against Gram-positive (Staphylococcus aureus (ATCC-25923), Enterococcus faecalis (clinical isolate), and Gram-negative (Klebsiella pneumoniae (clinical isolate), Escherichia coli (ATCC-2522), and Pseudomonas aeruginosa) bacteria. Antifungal activity was examined in vitro using Aspergillus niger, Candida albicans, Microsporum audouinii, and Cryptococcus neoformans as test organisms (clinical isolates). Cytotoxic assay was also performed in vitro at various concentrations. Results: The highly active compound in this study was 3-((2,6-di(furan-2-yl)dihydro-2H-thiopyran-4(3H)-ylidene)amino)dihydropyrimidine-2,4(1H,3H)-dione which exhibited the lowest MIC value (8 µg/mL) with broad activity against one Gram-positive and three Gram-negative. The compound, 3-((2,6-di(furan-2-yl)dihydro-2H-thiopyran-4(3H)-ylidene)amino)dihydropyrimidine-2,4(1H,3H)-dione showed least MIC value (MIC: 0.25 µg/mL) against C. albicans. The compound 3-((2,6-bis(4-hydroxyphenyl)dihydro-2H-thiopyran-4(3H)-ylidene)amino)dihydro pyrimidine-2,4(1H,3H)-dione was highly active (GI50 0.03 µm) against HeLa cancer cell lines. Conclusions: The overall results indicated that a successful preparation of a few of the promising molecules, which are antimicrobials well as cytotoxicity has been achieved.
Keywords	Piperidine-2,4-dione ; 2H-thiopyran cyclization method ; Antibacterial ; Antifungal ; Cytotoxic activity ; Science (General) ; Q1-390
Subject code	540
Language	English
Publishing date	2023-05-01T00:00:00Z
Publisher	Elsevier
Document type	Article ; Online
Database	BASE - Bielefeld Academic Search Engine (life sciences selection)

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Article ; Online: Vermiremediation

Radhakrishnan Surendrakumar / Akbar Idhayadhulla / Anis Ahamed / Hissah Abdulrahman Alodaini / Raman Gurusamy

Frontiers in Environmental Science, Vol

Analysis of contaminated diesel in soil using Eisenia fetida and ZnO nanoparticles with cow dung

2022 Volume 10

Abstract: Cow dung is a valuable source of manure to improve soil quality. This study aims to enhance the soil quality by decreasing diesel contamination in the soil through the vermicomposting of cow dung and nanoparticles of ZnO. Using a powder made from cow ... ...

Abstract	Cow dung is a valuable source of manure to improve soil quality. This study aims to enhance the soil quality by decreasing diesel contamination in the soil through the vermicomposting of cow dung and nanoparticles of ZnO. Using a powder made from cow dung, zinc ions may be easily converted into ZnO nanoparticles. To increase the quality of soil, Eisenia fetida and nanoparticles of ZnO mixed with cow dung was used. These nanoparticles were characterized by FT-IR, SEM, and TEM. The diesel impure soils were examined for 70 days by gas chromatography. Observations showed that the soil samples without the earthworms had a higher concentration of diesel than the earthworm present in the soil. In this method, diesel (4.5 ml) was reduced by almost 50% after 70 days. Diesel concentrations were significantly higher during sampling time than they were later in soil contaminated with E. fetida.
Keywords	diesel ; E. fetida ; ZnO (NPs) ; SEM ; TEM ; cow dung ; Environmental sciences ; GE1-350
Language	English
Publishing date	2022-10-01T00:00:00Z
Publisher	Frontiers Media S.A.
Document type	Article ; Online
Database	BASE - Bielefeld Academic Search Engine (life sciences selection)

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Article ; Online: Bis-(N-aminoethylethanolamine)-Copper(II) nanocatalysis (AEEA-Cu(II)-NPs) meditated to synthesis a series of 2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide derivatives

Chidambaram SathishKumar / Radhakrishnan Surendrakumar / Gurusamy Raman / Daoud Ali / Saud Alarifi / Akbar Idhayadhulla

Journal of King Saud University: Science, Vol 34, Iss 3, Pp 101872- (2022)

Characterization of theoretical, computational and evaluation of molecular docking, and cytotoxicity activities

2022

Abstract: In this work, bis-(N-aminoethylethanolamine)-Copper (II) nano (AEEA-Cu(II)-NPs) catalysis was synthesized and used as a catalyst in Biginelli reactions. Synthesized nanocatalysis was characterized by UV, FT-IR, XRD, SEM, and particle size distribution ... ...

Abstract	In this work, bis-(N-aminoethylethanolamine)-Copper (II) nano (AEEA-Cu(II)-NPs) catalysis was synthesized and used as a catalyst in Biginelli reactions. Synthesized nanocatalysis was characterized by UV, FT-IR, XRD, SEM, and particle size distribution analysis. The title compounds of thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide derivatives (1a-1o) were synthesized via Biginelli method, the reaction was carry out via AEEA-Cu(II)-NPs catalysis. Synthesized compounds (1a-1o) were characterized by FT-IR, 1H NMR, 13C NMR, mass spectrometry, and elemental analysis. The spectral data of compound 1a was confirmed by the comparison of both experimental and theoretical values. GC-EI-MS analysis of the characteristic protonation pathways for GC-EI-MS fragmentation of synthetic 2-thioxo-pyrimidine-5-carboxamide derivatives is reported. Computing methods of compound 1a was studied such as optimize the geometry, frontier molecular orbital analysis (HOMO-LUMO), and molecular electrostatic potential (MESP). In cytotoxicity screening, compounds were tested against. Cell lines 2HepG2 (liver), MCF-7 (breast), and HeLa (cervical) cancer cell lines. Molecular docking was used to determine the inter and intramolecular interactions. In order to determine the most effective pyrimidine derivatives (1f and 1 g) for the protein 4FM9, and Autodock Vina 1.1.2 software was used in conjunction with the binding mode of fluorouracil as a reference compound. The compounds 1f and 1g were extremely effective against HepG2 cells compared to fluorouracil. During docking studies, 1f showed a higher attraction for the 4FM9 protein (−6.5 kcal/mol) than fluorouracil (−5.4 kcal/mol). The compounds 1f, and 1g showed impressive inhibitory properties in cytotoxic screening as compared to the reference compound. Due to the docking studies and cytotoxicity screening results, the new compounds look promising as therapeutic agents.
Keywords	Biginelli reaction ; 2-Thioxo-pyrimidine-5-carboxamide ; Copper nanoparticles ; HOMO ; LUMO ; Science (General) ; Q1-390
Subject code	540
Language	English
Publishing date	2022-04-01T00:00:00Z
Publisher	Elsevier
Document type	Article ; Online
Database	BASE - Bielefeld Academic Search Engine (life sciences selection)

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Article ; Online: New Chitosan Polymer Scaffold Schiff Bases as Potential Cytotoxic Activity

Ponnusamy Packialakshmi / Perumal Gobinath / Daoud Ali / Saud Alarifi / Raman Gurusamy / Akbar Idhayadhulla / Radhakrishnan Surendrakumar

Frontiers in Chemistry, Vol

Synthesis, Molecular Docking, and Physiochemical Characterization

2022 Volume 9

Abstract: In this work, we synthesize the sulfonated Schiff bases of the chitosan derivatives 2a-2j without the use of a catalyst in two moderately straightforward steps with good yield within a short reaction time. The morphology and chemical structure of ... ...

Abstract	In this work, we synthesize the sulfonated Schiff bases of the chitosan derivatives 2a-2j without the use of a catalyst in two moderately straightforward steps with good yield within a short reaction time. The morphology and chemical structure of chitosan derivatives were investigated using FT-IR, NMR (1H—13C), XRD, and SEM. Furthermore, our chitosan derivatives were tested for their anticancer activity against the MCF-7 cancer cell line, and doxorubicin was used as a standard. In addition, the normal cell lines of the breast cancer cell MCF-10A, and of the lung cell MRC-5 were tested. Compound 2 h, with a GI50 value of 0.02 µM for MCF-7, is highly active compared with the standard doxorubicin and other compounds. The synthesized compounds 2a-2j exhibit low cytotoxicity, with IC50 > 100 μg/ml, against normal cell lines MCF-10A, MRC-5. We also provide the results of an in-silico study involving the Methoxsalen protein (1Z11). Compound 2h exhibits a higher binding affinity for 1Z11 protein (−5.9 kcal/mol) and a lower binding affinity for Doxorubicin (−5.3 kcal/mol) than certain other compounds. As a result of the aforementioned findings, the use of compound 2h has an anticancer drug will be researched in the future.
Keywords	schiff base ; SEM ; anticancer activity ; MCF-7 ; in-silico molecular docking ; structure activity relationship ; Chemistry ; QD1-999
Subject code	540
Language	English
Publishing date	2022-01-01T00:00:00Z
Publisher	Frontiers Media S.A.
Document type	Article ; Online
Database	BASE - Bielefeld Academic Search Engine (life sciences selection)

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Article ; Online: Correction

Perumal Gobinath / Ponnusamy Packialakshmi / Ali Daoud / Saud Alarifi / Akbar Idhayadhulla / Radhakrishnan Surendrakumar

Molecules, Vol 26, Iss 4, p

Gobinath, P., et al. Grindstone Chemistry: Design, One-Pot Synthesis, and Promising Anticancer Activity of Spiro[acridine-9,2′-indoline]-1,3,8-trione Derivatives against the MCF-7 Cancer Cell Line. Molecules 2020, 25 , 5862

2021 Volume 1131

Abstract: In the original article [.] ...

Abstract	In the original article [.]
Keywords	n/a ; Organic chemistry ; QD241-441
Language	English
Publishing date	2021-02-01T00:00:00Z
Publisher	MDPI AG
Document type	Article ; Online
Database	BASE - Bielefeld Academic Search Engine (life sciences selection)

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Article ; Online: Nanobased Antibacterial Drug Discovery to Treat Skin Infections of Staphylococcus aureus Using Moringa oleifera-Assisted Zinc Oxide Nanoparticle and Molecular Simulation Study

Perumal Gobinath / Ponnusamy Packialakshmi / Daoud Ali / Saud Alarifi / Raman Gurusamy / Akbar Idhayadhulla / Radhakrishnan SurendraKumar

BioMed Research International, Vol

2022 Volume 2022

Abstract: In addition to the physical barrier, the epidermis acts as a natural barrier against microbial proliferation. It is prone to bacterial infections on the skin and in the nose, such as Staphylococcus aureus, as well as a variety of other skin illnesses. ... ...

Abstract	In addition to the physical barrier, the epidermis acts as a natural barrier against microbial proliferation. It is prone to bacterial infections on the skin and in the nose, such as Staphylococcus aureus, as well as a variety of other skin illnesses. Green nanomaterial production, which eliminates the use of harmful chemicals while simultaneously reducing time, is gaining popularity in the nanotechnology area. Using the leaf extract of the pharmacologically valuable plant Moringa oleifera, we described a green synthesis of ZnO NPs (zinc oxide nanoparticles). ZnO NPs had a particle size of 201.6 nm and a zeta potential of -56.80 mV, respectively. A novel aminoketone antibacterial medication was synthesized and tested for antibacterial activity using ZnO NPs as a phytocatalyst in this work. This method produces high yields while maintaining efficient and gentle reaction conditions. Moringa oleifera extract can reduce ZnO to ZnO NPs in a straightforward manner. FT-IR, 1H-NMR, 13C-NMR, mass spectra, elemental analysis, and morphological analysis were used to synthesize and describe the antibacterial medicines (1a-1g) and (2a-2g). In addition, antibacterial activity was evaluated against bacteria such as Enterococcus faecalis and Staphylococcus aureus, and compound 1c (63 μg/mL, E. faecalis) and compound 2e (0.12 μg/mL, S. aureus) were found to be very active when compared to other medications. mupirocin is used as a reference. In addition, studies of in silico molecular docking for the bacterial DsbA protein were conducted. The strong molecules 1c (-4.3 kcal/mol) and 2e (-5.1 kcal/mol) exhibit a high binding affinity through hydrogen bonding, according to docking tests.
Keywords	Medicine ; R
Subject code	540
Language	English
Publishing date	2022-01-01T00:00:00Z
Publisher	Hindawi Limited
Document type	Article ; Online
Database	BASE - Bielefeld Academic Search Engine (life sciences selection)

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Article ; Online: Mosquito larvicidal activity of pyrrolidine-2,4-dione derivatives

Mohammed Al-Zharani / Mohammed S. Al-Eissa / Hassan A. Rudayni / Daoud ali / Saud alarifi / Radhakrishnan SurendraKumar / Akbar Idhayadhulla

Saudi Journal of Biological Sciences, Vol 29, Iss 4, Pp 2389-

An investigation against Culex quinquefasciatus and molecular docking studies

2022 Volume 2395

Abstract: The pyrrolidine-2,4-dione derivatives were used to conduct a larvicidal test on Culex quinquefasciatus larvae of the second instar. Mannich base condensation method was used to synthesis the pyrrolidine-2,4-dione derivatives by grindstone method. The ... ...

Abstract	The pyrrolidine-2,4-dione derivatives were used to conduct a larvicidal test on Culex quinquefasciatus larvae of the second instar. Mannich base condensation method was used to synthesis the pyrrolidine-2,4-dione derivatives by grindstone method. The reaction conditions were mild, resulting in high yields. An analysis of the synthesized compounds was carried out using FTIR, 1H NMR, 13C NMR, mass spectrometry, and elemental analysis. Synthesized compounds (1a-h) were evaluated for larvicidal activities. Compound 1e (LD50: 26.06 µg/mL), and 1f (LD50: 26.89 µg/mL), and were notably more active against Culex quinquefasciatus than permethrin (LD50: 26.14 µg/mL). The docking studies also demonstrated that 1e, and 1f are potent larvicides with higher binding energy (−12.6 kcal/mol) than the control in the mosquito odorant binding protein (PDB ID: 3OGN). The larvicidal properties of lead molecules have made them important for use as insecticides.
Keywords	Mannich base ; Pyrrolidine-2 ; 4-dione derivative ; Grindstone chemistry ; Larvicidal activity ; Culex quinquefasciatus ; Biology (General) ; QH301-705.5
Subject code	540
Language	English
Publishing date	2022-04-01T00:00:00Z
Publisher	Elsevier
Document type	Article ; Online
Database	BASE - Bielefeld Academic Search Engine (life sciences selection)

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Article ; Online: Pyrazolo[3,4-b]pyridin-3(2H)-one derivatives

Mohammed Al-Zharani / Mohammed S. Al-Eissa / Hassan A. Rudayni / Daoud Ali / Saad Alkahtani / Radhakrishnan Surendrakumar / Akbar Idhayadhulla

Journal of King Saud University: Science, Vol 34, Iss 2, Pp 101767- (2022)

Synthesis and their investigation of mosquito larvicidal activity

2022

Abstract: In this study, nitrogen-nitrogen bonds containing compounds such as hydrazine derivatives are examined. There are relatively few hydrazine molecules in nature, but some have been isolated from plants, marine organisms and microorganisms. Thus, hydrazine ... ...

Abstract	In this study, nitrogen-nitrogen bonds containing compounds such as hydrazine derivatives are examined. There are relatively few hydrazine molecules in nature, but some have been isolated from plants, marine organisms and microorganisms. Thus, hydrazine molecules are widely used in the manufacture of synthetic catalysts, agriculture chemicals, pesticides, and also cause irreversible pollution to air, water, and soil. Hydrazine compounds were evaluated via larvicidal profile in a stagnant water system. According to the above observation, new 1H-pyrazolo[3,4-b]pyridin-3(2H)-one derivatives can be synthesized via catalyst free green chemistry approach. A range of FT-IR spectroscopic measures, 1H and 13C NMR, as well as mass spectra, were used to characterize the compounds (2a-e). The compound 2e was more potent (95,6% mortality, LD50: 20.1 µg/ mL) against Culex quinquefasciatus than natural pyrazolidine derivatives. Therefore, the objective of this study, prospered with a few of the pyrzolopyridine hydrazine models, which are demonstrated to be low toxic environmentally safe and high potential larvicidal profile.
Keywords	Hydrazine ; Pyrazolo[3,4-b]pyridin ; Environmental toxicity ; Larvicidal activity ; Science (General) ; Q1-390
Subject code	540
Language	English
Publishing date	2022-02-01T00:00:00Z
Publisher	Elsevier
Document type	Article ; Online
Database	BASE - Bielefeld Academic Search Engine (life sciences selection)

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Article ; Online: Tyrosinase-mediated synthesis of larvicidal active 1,5-diphenyl pent-4-en-1-one derivatives against Culex quinquefasciatus and investigation of their ichthyotoxicity.

Chidambaram, SathishKumar / Ali, Daoud / Alarifi, Saud / Gurusamy, Raman / Radhakrishnan, SurendraKumar / Akbar, Idhayadhulla

Scientific reports

2021 Volume 11, Issue 1, Page(s) 20730

Abstract: 1,5-diphenylpent-4-en-1-one derivatives were synthesised using the grindstone method with Cu(II)-tyrosinase used as a catalyst. This method showed a high yield under mild reaction conditions. The synthesised compounds were identified by FTIR, ...

Abstract	1,5-diphenylpent-4-en-1-one derivatives were synthesised using the grindstone method with Cu(II)-tyrosinase used as a catalyst. This method showed a high yield under mild reaction conditions. The synthesised compounds were identified by FTIR,
Language	English
Publishing date	2021-10-20
Publishing country	England
Document type	Journal Article ; Research Support, Non-U.S. Gov't
ZDB-ID	2615211-3
ISSN	2045-2322 ; 2045-2322
ISSN (online)	2045-2322
ISSN	2045-2322
DOI	10.1038/s41598-021-98281-5
Database	MEDical Literature Analysis and Retrieval System OnLINE

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