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Synthesis, Characterization & Molecular Docking Study of Hydrazinylthiazole Derivatives as Antibacterial Agents

Synthesis, Characterization & Molecular Docking Study of Hydrazinylthiazole Derivatives as... Abstract Thiazole is a well-established scaffold due to its wide range of therapeutic activities. Moreover, the chromane nucleus is also associated with various biological activities such as antibacterial, anticancer, anti-inflammatory, and anti-HIV. We have reported herein thiazole derivatives clubbed with chromane nucleus intending to enhance the action as hybrid molecules. All the synthesized molecules have been confirmed based on spectroscopic techniques such as PMR, CMR, FT-IR & further supported by mass spectrometry. To check the potency of newly synthesized molecules, they have been evaluated against different strains of bacteria. Furthermore, to gain an insight into their plausible mechanism of action and thermodynamic interaction governing the binding of these molecules to their biological target, a molecular docking study was performed against bacterial DNA gyrase. The results of in silico binding affinity were found to be in harmony with the experimental activity. A complete design, synthesis, biological screening, and molecular docking experiment was planned and executed to lead with compounds exhibiting potential antibacterial activity. http://www.deepdyve.com/assets/images/DeepDyve-Logo-lg.png Analytical Chemistry Letters Taylor & Francis

Synthesis, Characterization & Molecular Docking Study of Hydrazinylthiazole Derivatives as Antibacterial Agents

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Synthesis, Characterization & Molecular Docking Study of Hydrazinylthiazole Derivatives as Antibacterial Agents

Abstract

Abstract Thiazole is a well-established scaffold due to its wide range of therapeutic activities. Moreover, the chromane nucleus is also associated with various biological activities such as antibacterial, anticancer, anti-inflammatory, and anti-HIV. We have reported herein thiazole derivatives clubbed with chromane nucleus intending to enhance the action as hybrid molecules. All the synthesized molecules have been confirmed based on spectroscopic techniques such as PMR, CMR, FT-IR &...
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Publisher
Taylor & Francis
Copyright
© 2022 Har Krishan Bhalla & Sons
ISSN
2230-7532
eISSN
2229-7928
DOI
10.1080/22297928.2021.1983873
Publisher site
See Article on Publisher Site

Abstract

Abstract Thiazole is a well-established scaffold due to its wide range of therapeutic activities. Moreover, the chromane nucleus is also associated with various biological activities such as antibacterial, anticancer, anti-inflammatory, and anti-HIV. We have reported herein thiazole derivatives clubbed with chromane nucleus intending to enhance the action as hybrid molecules. All the synthesized molecules have been confirmed based on spectroscopic techniques such as PMR, CMR, FT-IR & further supported by mass spectrometry. To check the potency of newly synthesized molecules, they have been evaluated against different strains of bacteria. Furthermore, to gain an insight into their plausible mechanism of action and thermodynamic interaction governing the binding of these molecules to their biological target, a molecular docking study was performed against bacterial DNA gyrase. The results of in silico binding affinity were found to be in harmony with the experimental activity. A complete design, synthesis, biological screening, and molecular docking experiment was planned and executed to lead with compounds exhibiting potential antibacterial activity.

Journal

Analytical Chemistry Letters – Taylor & Francis

Published: Mar 4, 2022

Keywords: Antibacterial activity; Molecular docking study; MIC; Spectral data; Thiazole derivatives

References

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