AC1O31MG structure

AC1O31MG

ethyl 4-[5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]furan-2-yl]piperazine-1-carboxylate

Also Known As: ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE|F0816-0273|(E)-ethyl 4-(5-(2-(benzo[d]thiazol-2-yl)-2-cyanovinyl)furan-2-yl)piperazine-1-carboxylate|ethyl 4-[5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]furan-2-yl]piperazine-1-carboxylate

CAS: 397288-82-3
Molecular Formula C21H20N4O3S
Molecular Weight 408.1256 g/mol
LogP 4.23198
Topological Polar Surface Area 82.6 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 4
Exact Mass 408.1256
Monoisotopic Mass 408.1256
Heavy Atoms 29
Complexity 1053.7349

Chemical Identifiers

CAS Number 397288-82-3
SMILES CCOC(=O)N1CCN(CC1)C2=CC=C(O2)/C=C(\C#N)/C3=NC4=CC=CC=C4S3

Product Overview

AC1O31MG (CAS 397288-82-3), with molecular formula C21H20N4O3S and molecular weight 408.1256 g/mol. IUPAC: ethyl 4-[5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]furan-2-yl]piperazine-1-carboxylate.

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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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