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Letters in Organic Chemistry

Editor-in-Chief

ISSN (Print): 1570-1786
ISSN (Online): 1875-6255

Letter Article

5-Methoxy-1-methyl-2-{[4-(2-hydroxyphenyl)piperazin-1-yl]methyl}-1Hindole (KAD22) with Antioxidant Activity

Author(s): Agnieszka A. Kaczor*, Karolina Wojtunik-Kulesza, Tomasz M. Wróbel, Dariusz Matosiuk and Monika Pitucha

Volume 19, Issue 4, 2022

Published on: 19 January, 2021

Page: [263 - 275] Pages: 13

DOI: 10.2174/1570178618666210119121438

Price: $65

Abstract

Compound KAD22 (5-methoxy-1-methyl-2-{[4-(2-hydroxyphenyl)piperazin-1-yl]methyl}- 1H-indole) was designed as a potential dopamine D2 receptor agonist with antioxidant activity for possible treatment of Parkinson’s disease. The compound was obtained from 5-methoxy-1-methyl-1H-indole- 2-carbaldehyde and 2-(piperazin-1-yl)phenol. KAD22 showed no affinity to dopamine D2 receptor but it is a potent antioxidant. Experimental and computational structural studies (conformational analysis, HOMO and LUMO orbitals, electrostatic potential map, non-covalent interaction plot, spectral properties, ligand-receptor interactions) of KAD22 were performed to address its biological activity.

Keywords: Antioxidant activity, dopamine receptors, indole derivatives, molecular modeling, Parkinson’s disease, structural studies.

Graphical Abstract
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