AC1LLKEU structure

AC1LLKEU

N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(2,5-dimethoxyphenyl)methanesulfonamide

Also Known As: CBKinase1_005314|CBKinase1_017714|BAS 06833130|BRD-K42964934-001-01-1|N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(2,5-dimethoxyphenyl)methanesulfonamide|N-[2-(3,4-Dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-N-(2,5-dimethoxy-phenyl)-methanesulfonamide|N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-(2,5-dimethoxyphenyl)methanesulfonamide

CAS: 700855-61-4
Molecular Formula C20H24N2O5S
Molecular Weight 404.1406 g/mol
LogP 2.0547
Topological Polar Surface Area 76.15 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 404.1406
Monoisotopic Mass 404.1406
Heavy Atoms 28
Complexity 974.3114

Chemical Identifiers

CAS Number 700855-61-4
SMILES COC1=CC(=C(C=C1)OC)N(CC(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C

Product Overview

AC1LLKEU (CAS 700855-61-4), with molecular formula C20H24N2O5S and molecular weight 404.1406 g/mol. IUPAC: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(2,5-dimethoxyphenyl)methanesulfonamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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