Quantum Chemical calculations of lattice energy for Clopidogrel picrate pseudopolymorphs

Cvetkovski, Aleksandar (2024) Quantum Chemical calculations of lattice energy for Clopidogrel picrate pseudopolymorphs. In: COST CA 22107 BEST-CST Project Meeting, 25-26 May 2024, Zagreb, Croatia.

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Abstract

The purpose of engineering multicomponent crystals of drug model Clopidogrel, potent antiplatelet drug, marketed as hydrogen sulfate salt
(ClopH+•HSO4
−) in Plavix® (BMS-Sanofi), encompassed cocrystallization screening of clopidogrel deprotonated (free) base with coformers from the
range of organic acids. The reported crystal structures relate to obtained two pseudopolymorphic forms of S(+)clopidogrel–picrate. Form 1 crystallizes in
the monoclinic space group P21 with an ionic couple S(+)ClopH+•Pic− and a molecule of solvent ethanol in the asymmetric unit, while Form 2
crystallizes in the monoclinic space group C2 with two ionic couples in the asymmetric unit. The configurations and conformations of the ionic couples,
held together by ionized +N-H···O hydrogen bonds, are nearly identical in the structures. [1]

Item Type: Conference or Workshop Item (Poster)
Subjects: Medical and Health Sciences > Basic medicine
Engineering and Technology > Chemical engineering
Natural sciences > Chemical sciences
Divisions: Faculty of Medical Science
Depositing User: Aleksandar Cvetkovski
Date Deposited: 15 Aug 2025 06:53
Last Modified: 15 Aug 2025 06:54
URI: https://eprints.ugd.edu.mk/id/eprint/36272

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