2-{[4-(2-Methylpropanoylamino)phenyl]carbonylamino}benzoic acid structure

2-{[4-(2-Methylpropanoylamino)phenyl]carbonylamino}benzoic acid

2-[[4-(2-methylpropanoylamino)benzoyl]amino]benzoic acid

Also Known As: CBMicro_001593|Oprea1_065674|2-(4-isobutyramidobenzamido)benzoic acid|BIM-0001458.P001|SR-01000441654-1|2-[[4-(2-methylpropanoylamino)benzoyl]amino]benzoic acid|2-[({4-[(2-methylpropanoyl)amino]phenyl}carbonyl)amino]benzoic acid|2-{[4-(2-methylpropanoylamino)phenyl]carbonylamino}benzoic acid

CAS: 294891-76-2
Molecular Formula C18H18N2O4
Molecular Weight 326.12665 g/mol
LogP 3.8
Topological Polar Surface Area 95.5 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 4
Rotatable Bonds 5
Exact Mass 326.12665
Monoisotopic Mass 326.12665
Heavy Atoms 24
Complexity 470.0

Chemical Identifiers

CAS Number 294891-76-2
SMILES CC(C)C(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)O
InChIKey KERDHFVYBIIJMS-UHFFFAOYSA-N

Product Overview

2-{[4-(2-Methylpropanoylamino)phenyl]carbonylamino}benzoic acid (CAS 294891-76-2), with molecular formula C18H18N2O4 and molecular weight 326.12665 g/mol. IUPAC: 2-[[4-(2-methylpropanoylamino)benzoyl]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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2-{[4-(2-Methylpropanoylamino)phenyl]carbonylamino}benzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.

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