6SAM-cpd13
Ligand combining cholinesterase and monoamine oxidase inhibition. IC50 = 0.06 muM for BCHE
General
Type : Multitarget, Piperidine, Inden, Monoamine-oxidase-inhibitor, Carbamate
Chemical_Nomenclature : 1-(2,3-dihydro-1H-inden2-yl)piperidin-3-yl N-phenyl carbamate || [(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl] N-phenylcarbamate
Canonical SMILES : C1=CC2=C(C=C1)CC(C2)N3CCCC(C3)OC(NC4=CC=CC=C4)=O || C1CC(C[NH+](C1)C2CC3=CC=CC=C3C2)OC(=O)NC4=CC=CC=C4
InChI : InChI=1S\/C21H24N2O2\/c24-21(22-18-9-2-1-3-10-18)25-20-11-6-12-23(15-20)19-13-16-7-4-5-8-17(16)14-19\/h1-5,7-10,19-20H,6,11-15H2,(H,22,24) || InChI=1S\/C21H24N2O2\/c24-21(22-18-9-2-1-3-10-18)25-20-11-6-12-23(15-20)19-13-16-7-4-5-8-17(16)14-19\/h1-5,7-10,19-20H,6,11-15H2,(H,22,24)\/p+1\/t20-\/m0\/s1
InChIKey : ISMYNYFEVMBAEI-UHFFFAOYSA-N || ISMYNYFEVMBAEI-FQEVSTJZSA-O
Other name(s) : L3H
MW : 336.43 || 337.4
Formula : C21H24N2O2 || C21H25N2O2+
CAS_number :
PubChem : 146035902
UniChem : ISMYNYFEVMBAEI-UHFFFAOYSA-N, ISMYNYFEVMBAEI-FQEVSTJZSA-O
Target
References (1)
| Title : N-alkylpiperidine carbamates as potential anti-Alzheimer's agents - Kosak_2020_Eur.J.Med.Chem_197_112282 |
| Author(s) : Kosak U , Strasek N , Knez N , Jukic M , Zakelj S , Zahirovic A , Pislar A , Brazzolotto X , Nachon F , Kos J , Gobec S , Knez D |
| Ref : Eur Journal of Medicinal Chemistry , 197 :112282 , 2020 |
| Abstract : |
| PubMedSearch : Kosak_2020_Eur.J.Med.Chem_197_112282 |
| PubMedID: 32380361 |
| Gene_locus related to this paper: human-BCHE |