AC1LXWMN structure

AC1LXWMN

(Z)-3-(3-acetylanilino)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile

Also Known As: (Z)-3-((3-acetylphenyl)amino)-2-(4-(3,4-dimethoxyphenyl)thiazol-2-yl)acrylonitrile|(Z)-3-(3-acetylanilino)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile|(2Z)-3-[(3-acetylphenyl)amino]-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile

CAS: 683258-72-2
Molecular Formula C22H19N3O3S
Molecular Weight 405.11472 g/mol
LogP 5.00648
Topological Polar Surface Area 84.24 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 7
Exact Mass 405.11472
Monoisotopic Mass 405.11472
Heavy Atoms 29
Complexity 1112.4855

Chemical Identifiers

CAS Number 683258-72-2
SMILES CC(=O)C1=CC(=CC=C1)N/C=C(/C#N)\C2=NC(=CS2)C3=CC(=C(C=C3)OC)OC

Product Overview

AC1LXWMN (CAS 683258-72-2), with molecular formula C22H19N3O3S and molecular weight 405.11472 g/mol. IUPAC: (Z)-3-(3-acetylanilino)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile.

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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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