AC1LXZ9R structure

AC1LXZ9R

(Z)-3-(3-acetylanilino)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]prop-2-enenitrile

Also Known As: (Z)-3-((3-acetylphenyl)amino)-2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)acrylonitrile|(Z)-3-(3-acetylanilino)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]prop-2-enenitrile|(2Z)-3-[(3-acetylphenyl)amino]-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]prop-2-enenitrile

CAS: 683258-76-6
Molecular Formula C21H15N3O3S
Molecular Weight 389.0834 g/mol
LogP 4.71798
Topological Polar Surface Area 84.24 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 5
Exact Mass 389.0834
Monoisotopic Mass 389.0834
Heavy Atoms 28
Complexity 1127.9197

Chemical Identifiers

CAS Number 683258-76-6
SMILES CC(=O)C1=CC(=CC=C1)N/C=C(/C#N)\C2=NC(=CS2)C3=CC4=C(C=C3)OCO4

Product Overview

AC1LXZ9R (CAS 683258-76-6), with molecular formula C21H15N3O3S and molecular weight 389.0834 g/mol. IUPAC: (Z)-3-(3-acetylanilino)-2-[4-(1,3-benzodioxol-5-yl)-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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