AC1MIHO1 structure

AC1MIHO1

N-[(8-methoxy-1-methyl-5-thiophen-3-yl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-3-carboxamide;hydrochloride

Also Known As: 3-Thiophenecarboxamide, N-((2,3-dihydro-8-methoxy-1-methyl-5-(3-thienyl)-1H-1,4-benzodiazepin-2-yl)methyl)-, monohydrochloride|N-[(8-methoxy-1-methyl-5-thiophen-3-yl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-3-carboxamide hydrochloride|N-{[8-Methoxy-1-methyl-5-(thiophen-3-yl)-2,3-dihydro-1H-1,4-benzodiazepin-2-yl]methyl}thiophene-3-carboximidic acid--hydrogen chloride (1/1)

CAS: 84671-53-4
Molecular Formula C21H22ClN3O2S2
Molecular Weight 447.0842 g/mol
LogP 4.3258
Topological Polar Surface Area 53.93 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 5
Exact Mass 447.0842
Monoisotopic Mass 447.0842
Heavy Atoms 29
Complexity 987.54205

Chemical Identifiers

CAS Number 84671-53-4
SMILES CN1C(CN=C(C2=C1C=C(C=C2)OC)C3=CSC=C3)CNC(=O)C4=CSC=C4.Cl

Product Overview

AC1MIHO1 (CAS 84671-53-4), with molecular formula C21H22ClN3O2S2 and molecular weight 447.0842 g/mol. IUPAC: N-[(8-methoxy-1-methyl-5-thiophen-3-yl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]thiophene-3-carboxamide;hydrochloride.

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