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September 17, 2026PharmaceuticalsOpen Access

Synthesis, Characterization, Biological Evaluation and In Silico Studies of Some New Thiazole Derivatives

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Authors

TCTugce CakliliYSYusuf SıcakSCSomdatta Y. Chaudhari

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Overview

In vitro study demonstrates potent antioxidant, antidiabetic, and anticholinesterase activities in novel thiazole derivatives, indicating therapeutic potential for neurodegenerative and metabolic...

Key Points

  • To synthesize and characterize a novel series of thiazole derivatives bearing a benzodioxole scaffold and evaluate their antioxidant, anticholinesterase, and antidiabetic potential.
  • Synthesized nine thiazole-benzodioxole derivatives (compounds 1–9) and confirmed their structures.
  • Assessed in vitro antioxidant capacity using ABTS and DPPH assays, and measured enzyme inhibition against AChE, BChE, α-amylase, and α-glucosidase.
  • Conducted molecular docking, molecular dynamics simulations, and in silico ADMET pharmacokinetic predictions.
  • Compounds 8 (4-trifluoromethyl) and 9 (phenyl) exhibited the strongest ABTS and DPPH radical scavenging activities, driven by efficient hydrogen atom transfer and extended π-conjugation.
  • Compounds 3 (4-SO2CH3) and 5 (3,4-diCl) bearing electron-withdrawing groups demonstrated superior dual inhibition of AChE/BChE and α-amylase/α-glucosidase, outperforming the reference antidiabetic drug acarbose.

Cite This Study

Caklili et al. (2026) studied this question.

synapsesocial.com/papers/6aabb6725f706d05830e4e35https://doi.org/10.3390/ph19091468
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