Synthesis, crystal structure, DFT calculations, in-vitro and in-silico studies of novel chromone-isoxazoline conjugates as antibacterial and anti-inflammatory agents

Synthesis, crystal structure, DFT calculations, in-vitro and in-silico studies of novel chromone-isoxazoline conjugates as antibacterial and anti-inflammatory agents

Abstract In this study, we report the synthesis and biological evaluation of a novel series of chromone-isoxazoline hybrids. These conjugates were successfully synthesized through N-alkylation and 1,3-dipolar cycloaddition reactions, and their structures were determined by spectroscopic analysis (1H...

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Bibliographic Details
Main Authors: Rachid Bouzammit, Naoufal El Hachlafi, Mohamed El fadili, Mouna El Khabchi, Youssra Kanzouai, Rachid Salghi, Mohammed M. Alanazi, Mohammed Chalkha, Alexandra M. Pop, Emese Gal, Luiza Ioana Gaina, Ghali Al Houari
Format: Article
Language:English
Published: Nature Portfolio 2025-08-01
Series:Scientific Reports
Subjects:
Synthesis
X-ray diffraction
Chromone-isoxazoline
Antibacterial activity
Anti-inflammatory activity
Molecular docking and DFT study
Online Access:https://doi.org/10.1038/s41598-025-11182-9
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https://doi.org/10.1038/s41598-025-11182-9

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