Melatonin-alkylbenzylamine-Cpd5

huBuChE IC(50)=1.20 microM, huAChE IC(50) = 177.49 microM

General

Type : Antioxidant,Derivative of Tryptamine,Indole,Multitarget,Alkyl linked bis-ligand

Chemical_Nomenclature : 5-hydroxy-1-(12-((3-hydroxybenzyl)(methyl)amino)dodecyl)-1H-indole-3-carbaldehyde

Canonical SMILES : C(CCCCCCCCN(CC1=CC(=CC=C1)O)C)CCC[N]3C2=CC=C(C=C2C(=C3)C=O)O

InChI : InChI=1S\/C29H40N2O3\/c1-30(21-24-13-12-14-26(33)19-24)17-10-8-6-4-2-3-5-7-9-11-18-31-22-25(23-32)28-20-27(34)15-16-29(28)31\/h12-16,19-20,22-23,33-34H,2-11,17-18,21H2,1H3

InChIKey : FSMMMQWAIKAMQM-UHFFFAOYSA-N

Other name(s) :


MW : 465.31

Formula : C29H40N2O3

CAS_number :

PubChem :

UniChem : FSMMMQWAIKAMQM-UHFFFAOYSA-N

IUPHAR :

Wikipedia :

Target

Families : Melatonin-alkylbenzylamine-Cpd5 ligand of proteins in family: BCHE

Stucture :

Protein :

References (1)

Title : Dual functional antioxidant and butyrylcholinesterase inhibitors for the treatment of Alzheimer's disease: Design, synthesis and evaluation of novel melatonin-alkylbenzylamine hybrids - Liu_2023_Bioorg.Med.Chem_78_117146
Author(s) : Liu P , Cheng M , Guo J , Cao D , Luo J , Wan Y , Fang Y , Jin Y , Xie SS , Liu J
Ref : Bioorganic & Medicinal Chemistry , 78 :117146 , 2023
Abstract : Liu_2023_Bioorg.Med.Chem_78_117146
ESTHER : Liu_2023_Bioorg.Med.Chem_78_117146
PubMedSearch : Liu_2023_Bioorg.Med.Chem_78_117146
PubMedID: 36580744