Coumarin-Pyridine-3f

AChE inhibitor (IC50 = 2 nM) BuChE inhibitor activity (IC50 = 24 nM)

General

Type : Coumarin,Pyridine

Chemical_Nomenclature : 1-(3-(4-(6-Nitro-2-oxo-2H-chromen-3-yl)phenoxy) propyl)pyridinium Bromide

Canonical SMILES : C1(=CC=C2C(=C1)C=C(C(O2)=O)C3=CC=C(C=C3)OCCC[N+]4=CC=CC=C4)[N+](=O)[O-].[Br-]

InChI : InChI=1S\/C23H19N2O5.BrH\/c26-23-21(16-18-15-19(25(27)28)7-10-22(18)30-23)17-5-8-20(9-6-17)29-14-4-13-24-11-2-1-3-12-24\;\/h1-3,5-12,15-16H,4,13-14H2\;1H\/q+1\;\/p-1

InChIKey : FGLFWZQQABVJGL-UHFFFAOYSA-M

Other name(s) :


MW : 483.31

Formula : C23H19BrN2O5

CAS_number :

PubChem :

UniChem : FGLFWZQQABVJGL-UHFFFAOYSA-M

IUPHAR :

Wikipedia :

Target

Families : Coumarin-Pyridine-3f ligand of proteins in family: ACHE || BCHE

Stucture :

Protein : human-ACHE || human-BCHE

References (1)

Title : Novel Coumarin-Pyridine Hybrids as Potent Multi-Target Directed Ligands Aiming at Symptoms of Alzheimer's Disease - Babaei_2022_Front.Chem_10_895483
Author(s) : Babaei E , Kucukkilinc TT , Jalili-Baleh L , Nadri H , Oz E , Forootanfar H , Hosseinzadeh E , Akbari T , Ardestani MS , Firoozpour L , Foroumadi A , Sharifzadeh M , Mirjalili BBF , Khoobi M
Ref : Front Chem , 10 :895483 , 2022
Abstract : Babaei_2022_Front.Chem_10_895483
ESTHER : Babaei_2022_Front.Chem_10_895483
PubMedSearch : Babaei_2022_Front.Chem_10_895483
PubMedID: 35844650