Molecular recognition of flunarizine dihydrochloride and β-cyclodextrin inclusion complex by NMR and computational approaches.

ABSTRACT:

Background

Flunarizine dihydrochloride (FLN) is used in the prophylactic treatment of migraine, vertigo, occlusive peripheral vascular disease and epilepsy. Cyclodextrins (CDs) are chiral, truncated cone shaped macrocycles known for their inner hydrophobic and outer hydrophilic site. They form complexes with hydrophobic drug molecules and enhance the solubility and bioavailability of such compounds by enhancing drug permeability through mucosal tissues. NMR spectroscopy and computational docking have been recognized as an important tool for the interaction study of CDs-drug inclusion complexes in solution state.

Results

The structural assignments of FLN and β-CD protons were determined by ¹H NMR and 2D ¹H-¹H COSY NMR spectroscopy. ¹

SUBMITTER: Upadhyay SK 

PROVIDER: S-EPMC5871610 | biostudies-literature | 2018 Mar

REPOSITORIES: biostudies-literature