AC1NC091 structure

AC1NC091

4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-[2-(dimethylamino)ethyl]-5-(4-hydroxyphenyl)pyrrolidine-2,3-dione

Also Known As: 4-(3-chloro-4-ethoxybenzoyl)-1-[2-(dimethylamino)ethyl]-3-hydroxy-5-(4-hydroxyphenyl)-2,5-dihydro-1H-pyrrol-2-one|4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-(2-dimethylaminoethyl)-5-(4-hydroxyphenyl)pyrrolidine-2,3-dione

CAS: 867136-83-2
Molecular Formula C23H25ClN2O5
Molecular Weight 444.1452 g/mol
LogP 3.4276
Topological Polar Surface Area 90.31 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 7
Exact Mass 444.1452
Monoisotopic Mass 444.1452
Heavy Atoms 31
Complexity 1017.12695

Chemical Identifiers

CAS Number 867136-83-2
SMILES CCOC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN(C)C)C3=CC=C(C=C3)O)O)Cl

Product Overview

AC1NC091 (CAS 867136-83-2), with molecular formula C23H25ClN2O5 and molecular weight 444.1452 g/mol. IUPAC: 4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-1-[2-(dimethylamino)ethyl]-5-(4-hydroxyphenyl)pyrrolidine-2,3-dione.

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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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