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In vitro and in silico biological studies of novel thiazolo[3,2-a]pyrimidine-6-carboxylate derivatives

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Title In vitro and in silico biological studies of novel thiazolo[3,2-a]pyrimidine-6-carboxylate derivatives
 
Creator Umesha K, Sarojini BK, Darshan Raj CG, Bhanuprakash V, Yogisharadhya R, Raghavendra R, Mahmud T, Khan H
 
Subject Thiazolo[3,2-a]pyrimidine-6-carboxylate, In vitro antimicrobial activity, In vitro antiviral activity,In silico docking studies
 
Description In the present study, we report the synthesis,characterization of new series of thiazolo[3,2-a]pyrimi-dine-6-carboxylate derivatives 3a–f and 4a–f. The newlysynthesized compounds were screened for in vitro antimi-crobial and antiviral activities. The probable mode ofaction of these active compounds was determined throughin silico docking study by docking the receptor methionyl-tRNA synthetase and human inosine-50-monophosphatedehydrogenase (IMPDH) for antibacterial and antiviralactivities, respectively. Among the compounds, 4c exhib-ited excellent in vitro antimicrobial activity against alltested strains with binding and docking energies -35.6 and-12.4 kcal/mol, respectively. The antiviral studies werecarried out for the selected compounds in which 4aexhibited 73.69 and 54.42 % of inhibition of buffalopoxand camelpox viruses, respectively. Furthermore, com-pound 4a showed minimum docking and binding energyalong with the maximum hydrogen/hydrophobic interac-tion with IMPDH. The study contributes towards identifi-cation and screening of potential antimicrobial andantiviral agent’s against the pathogens
 
Date 2023-05-16T09:44:38Z
2023-05-16T09:44:38Z
2013-05-23
 
Type Research Paper
 
Identifier http://krishi.icar.gov.in/jspui/handle/123456789/77493
 
Language English
 
Publisher Springer