Article 2021 · 21 citations

An efficient synthesis of novel di-heterocyclic benzazole derivatives and evaluation of their antiproliferative activities

Algul, Oztekin, Ersan, Ronak Haj, Alagoz, Mehmet Abdullah, Duran, Nizami, Burmaoglu, Serdar

Abstract

A series of unsymmetrical nine di-heterocyclic compounds of benzazole derivatives were synthesized at one step via cyclization reaction. The compounds evaluated forin vitrocytotoxic activity against A549, A498, HeLa, and HepG2 cancer cell lines. The biological evaluation results show that23, 26and29exhibit better activity against HepG2 and HeLa cancer cell lines. Compound23also showed good activity against A549, and A498 cancer cell lines. The analogs were further performed molecular docking studies against human cytochrome P450 2C8 monooxygenase enzyme, calculated some theoretical quantum parameters, ADMET descriptor and molecular electrostatic potential analysis. The strategy applied in this research work may act as a perspective for the rational design of potential anticancer drugs. Communicated by Ramaswamy H. Sarma

Keywords

Di-heterocyclic structure benzimidazole benzothiazole benzoxazole benzazole polyphosphoric acid antiproliferative activity molecular docking ADMET BENZIMIDAZOLES COMPLEXES POTENT BENZOTHIAZOLYL METABOLITE BINDING

WoS Categories

Biochemistry & Molecular Biology Biophysics

Sustainable Development Goals

Good Health and Well-being

Citation

Journal: JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS
Year: 2021
Volume: 39
Issue: 18
Pages: 6926-6938
ISSN: 0739-1102
eISSN: 1538-0254
DOI: 10.1080/07391102.2020.1803966
WoS UID: WOS:000557611000001

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