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Growing Science » Current Chemistry Letters » Design, synthesis, and antidiabetic evaluation of novel 1,3-di(1,3,4-oxadiazol-2-yl)benzene derivatives as potent pancreatic α-amylase inhibitors: In vitro and in silico approaches

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Current Chemistry Letters

ISSN 1927-730x (Online) - ISSN 1927-7296 (Print)
Quarterly Publication
Volume 15 Issue 1 pp. 175-192 , 2026

Design, synthesis, and antidiabetic evaluation of novel 1,3-di(1,3,4-oxadiazol-2-yl)benzene derivatives as potent pancreatic α-amylase inhibitors: In vitro and in silico approaches Pages 175-192 Right click to download the paper Download PDF

Authors: Assiya Atif, Mohamed Marghich, Nor Nabil, Abouelhaoul El Alami, Nour Elhouda Daoudi, Tarik Harit, Fatima Youssoufi, Mohammed Salah, Abdelali Bitar, Houssine Ait Sir

DOI: 10.5267/j.ccl.2025.9.003

Keywords: Synthesis Molecular docking Molecular dynamics Diabetes α-amylase

Abstract: The synthesis of a new family of 1,3-di(1,3,4-oxadiazol-2-yl)benzene derivatives is reported. Their structures were characterized using standard spectroscopic techniques such FT-IR, ¹H-NMR, ¹³C-NMR spectroscopies and mass spectrometry. The antidiabetic potential of these synthetic molecules was evaluated by determining their in vitro inhibitory activity against pancreaticα-amylase enzymes. In addition, in silico molecular docking and pharmacokinetic simulations were performed to examine the compounds binding interactions with the enzyme active site and to assess their ADMET properties. Compared the used positive control, the obtained results show that all 1,3-di(1,3,4-oxadiazol-2-yl)benzene derivatives demonstrated a good potency to inhibit the α-amylase enzyme, Especially, the 2,2'-(1,3-phenylebis(1,3,4-oxadiazole-5,2-diyl))dianiline (5d) with IC50 of 0.393 mg/mL. Furthermore, the experimental findings were supported by molecular dynamics, docking and ADMET studies. The obtained data emphasizes compound 5d as potential as safe and effective therapeutic agents targeting the pancreatic α-amylase enzyme.

How to cite this paper
Atif, A., Marghich, M., Nabil, N., Alami, A., Daoudi, N., Harit, T., Youssoufi, F., Salah, M., Bitar, A & Sir, H. (2026). Design, synthesis, and antidiabetic evaluation of novel 1,3-di(1,3,4-oxadiazol-2-yl)benzene derivatives as potent pancreatic α-amylase inhibitors: In vitro and in silico approaches.Current Chemistry Letters, 15(1), 175-192.

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Journal: Current Chemistry Letters | Year: 2026 | Volume: 15 | Issue: 1 | Views: 149 | Reviews: 0

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