BRN 0699796

4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]benzoic acid

CAS: 32683-54-8

Molecular Formula	`C18H17N3O3`
Molecular Weight	323.3 g/mol
LogP	1.9
Topological Polar Surface Area	72.9 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	323.12698
Heavy Atoms	24
Complexity	532.0

Chemical Identifiers

CAS Number	32683-54-8
SMILES	`CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=CC=C(C=C3)C(=O)O`
InChIKey	`RLMROJFOKGLOEJ-UHFFFAOYSA-N`

📖 Product Overview

BRN 0699796 (CAS: 32683-54-8) is a chemical compound with molecular formula C18H17N3O3 and molecular weight 323.3 g/mol. Its IUPAC systematic name is 4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]benzoic acid. LogP 1.9 Topological Polar Surface Area 72.9 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 4 Exact Mass 323.12698 Heavy Atoms 24 Complexity 532.0 InChI Key: RLMROJFOKGLOEJ-UHFFFAOYSA-N. SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=CC=C(C=C3)C(=O)O.

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