Synthesis, characterization and pharmacological evaluation of some new 1,3,4-oxadiazole derivatives bearing 3-chloro-2-fluoro phenyl moiety

Autor:	Gundibasappa Karikannar Nagaraja, Reshma Kayarmar, H. Manjunatha, S. V. Raghavendra, K. P. Rajesh, Manjunatha Bhat
Rok vydání:	2016
Předmět:	010405 organic chemistry Stereochemistry Aryl Protein Data Bank (RCSB PDB) General Chemistry Carbon-13 NMR 010402 general chemistry 01 natural sciences 0104 chemical sciences chemistry.chemical_compound chemistry Sulfanyl In vivo Proton NMR Moiety Benzoic acid
Zdroj:	Research on Chemical Intermediates. 42:7771-7792
ISSN:	1568-5675 0922-6168
DOI:	10.1007/s11164-016-2561-4
Popis:	A new series of 2-(3-chloro-2-fluorophenyl)-5-aryl-1,3,4-oxadiazole (3a–j) and 2-(aryl sulfanyl)-5-(3-chloro-2-fluorophenyl)-1,3,4-oxadiazole (5a–e) were synthesized via a multistep reaction from 3-chloro-2-fluoro benzoic acid. The newly synthesized compounds were characterized by IR, 1H NMR, 13C NMR, mass spectral data and elemental analysis. They were also screened for their in vivo anti-convulsant and anti-inflammatory activities. Some of them exhibited significant biological activities and were well supported by in silico molecular docking studies for the inhibition of cyclooxygenase-2 (PDB ID: 1CX2) and voltage-gated sodium channels (PDB ID: 4F4L) comparable with the standard drugs. Thus, they were believed to be good inhibitors of cyclooxygenase-2 (PDB ID: 1CX2) and voltage-gated sodium channels (PDB ID: 4F4L).
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::24279238f124a982604857193d2ad57f https://doi.org/10.1007/s11164-016-2561-4 Zobrazit plný text záznamu Plný text ve formátu PDF