AC1MXZHQ structure

AC1MXZHQ

3-[(5-ethoxycarbonyl-5-methyl-2-oxo-1-phenylpyrrol-3-yl)amino]benzoic acid

Also Known As: NCGC00100416-01|AG-205/12229440|A1904/0080001|SR-01000111808-1|3-{[5-(ethoxycarbonyl)-5-methyl-2-oxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl]amino}benzoic acid|3-[(5-ethoxycarbonyl-5-methyl-2-oxo-1-phenylpyrrol-3-yl)amino]benzoic acid|3-((5-(ethoxycarbonyl)-5-methyl-2-oxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl)amino)benzoic acid

CAS: 496809-38-2
Molecular Formula C21H20N2O5
Molecular Weight 380.1372 g/mol
LogP 3.0492
Topological Polar Surface Area 95.94 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 380.1372
Monoisotopic Mass 380.1372
Heavy Atoms 28
Complexity 954.27814

Chemical Identifiers

CAS Number 496809-38-2
SMILES CCOC(=O)C1(C=C(C(=O)N1C2=CC=CC=C2)NC3=CC=CC(=C3)C(=O)O)C

Product Overview

AC1MXZHQ (CAS 496809-38-2), with molecular formula C21H20N2O5 and molecular weight 380.1372 g/mol. IUPAC: 3-[(5-ethoxycarbonyl-5-methyl-2-oxo-1-phenylpyrrol-3-yl)amino]benzoic acid.

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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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