Open AccessSynthesis, in vitro Antimicrobial Evaluation, Molecular Docking Studies and ADME Prediction of Furan-2-yl-Morpholinophenylpyrimidine Derivatives
Author(s) -
M.R. Ezhilarasi,
A.B. Senthieel Khumar,
Pandian Elavarasan
Publication year - 2021
Publication title -
asian journal of chemistry/asian journal of chemistry
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.145
H-Index - 34
eISSN - 0975-427X
pISSN - 0970-7077
DOI - 10.14233/ajchem.2021.23148
Subject(s) - adme , chemistry , docking (animal) , in silico , pyrimidine , stereochemistry , antimicrobial , combinatorial chemistry , in vitro , furan , carbon 13 nmr , biochemistry , organic chemistry , medicine , nursing , gene
A new series of novel 4-(furan-2-yl)-6-(4-morpholinophenyl)pyrimidine-amines (4a-c) weresynthesized and characterized by elemental analysis and spectral analysis like IR, 1D 1H & 13C NMR.The synthesized compounds 4a-c were evaluated for their biological studies. The zone of inhibitionswere examined for synthesized compounds 4a-c besides the identical set of microbial strains, especiallythat compound 4a against S. aureus, S. pyogenes, E. coli, compound 4b against P. aeruginosa hasexcellent antibacterial activity. Compound 4c shows good inhibition against C. albicans. Also in silicomolecular docking and ADME predictions were carried for all the compounds. The docking studieswere examined by two different proteins like 1UAG protein and 1OQA protein. in silico dockingprovides of the compounds have good docking score compared with the standard. In the ADMEpredictions all the compounds were met criteria. The synthesized compounds all of them obeyed thedrug-likeness properties.