Synthesis of novel furan-based chalcone derivatives as anti-tuberculosis agents: <i>in vitro</i>, cytotoxicity assessment and <i>in silico</i>
Dhivya LS, Kumaradoss KM
Future medicinal chemistry · 2023-09
Abstract
Background: The aim of the study is to identify a novel furan-based chalcone derivative as potent inhibitor against the H37Rv strain . Materials & methods: The in silico pharmacokinetic characteristics, toxicity tests, molecular modeling, chemical synthesis and minimum inhibitory concentration (MIC; IC 50 ) were carried out to evaluate the antitubercular potential of the synthesized furan-based chalcone analogues against H37Rv. Results & conclusion: Among the ten target compounds synthesized, DF02, DF05 and DF07 had MIC values of 1.6 μg/ml equivalent to isoniazid and DF10 showed MIC values of 3.25 μg/ml which is equipotent to pyrazinamide. All the other compounds had optimal concentrations 6.25-100 μg/ml against the H37Rv strain. Compounds DF02 and DF10 were further evaluated for cytotoxicity assay performed using HeLa cell lines.
MeSH terms
- Hela Cells
- Humans
- Mycobacterium tuberculosis
- Chalcones
- Chalcone
- Antitubercular Agents
- Microbial Sensitivity Tests
- Structure-Activity Relationship
- Molecular Docking Simulation