4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid

C23H17N3O3 — CID 67343979

IUPAC4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid
SMILESO=C(Nc1cc(-c2ccccc2)ccc1C(=O)O)c1cc(-c2ccccc2)n[nH]1
InChIInChI=1S/C23H17N3O3/c27-22(21-14-19(25-26-21)16-9-5-2-6-10-16)24-20-13-17(11-12-18(20)23(28)29)15-7-3-1-4-8-15/h1-14H,(H,24,27)(H,25,26)(H,28,29)
InChIKeyBDWQDRVMOMZLKV-UHFFFAOYSA-N
MW383.41 g/mol
LogP4.69
Rot. Bonds5

About 4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid

4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid (PubChem CID 67343979) has the molecular formula C23H17N3O3 and a molecular weight of 383.41 g/mol. Its IUPAC name is 4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid.

Molecular Properties

Compound Name4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid
PubChem CID67343979
Molecular FormulaC23H17N3O3
Molecular Weight383.41 g/mol
Exact Mass383.13
IUPAC Name4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid
SMILESO=C(Nc1cc(-c2ccccc2)ccc1C(=O)O)c1cc(-c2ccccc2)n[nH]1
InChIInChI=1S/C23H17N3O3/c27-22(21-14-19(25-26-21)16-9-5-2-6-10-16)24-20-13-17(11-12-18(20)23(28)29)15-7-3-1-4-8-15/h1-14H,(H,24,27)(H,25,26)(H,28,29)
InChIKeyBDWQDRVMOMZLKV-UHFFFAOYSA-N
XLogP4.69
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.41
LogP ≤ 54.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(2-carboxybenzoyl)amino]-4-phenylbenzoic acid
CID 167346908
N-[2-methyl-5-(2-phenylethyl)phenyl]-3-phenyl-1H-pyrazole-5-carboxamide;4-(2-phenylethyl)-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid
CID 91442408
2-[(2,4-difluorobenzoyl)amino]-4-phenylbenzoic acid
CID 67343264
N-(3-hydroxy-2-pyridinyl)-3-phenyl-1H-pyrazole-5-carboxamide
CID 18109569
N-(4-acetamidophenyl)-3-phenyl-1H-pyrazole-5-carboxamide
CID 26273244
N'-(2-hydroxybenzoyl)-3-phenyl-1H-pyrazole-5-carbohydrazide
CID 27698464
2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid
CID 46853577
2-[(2-hydroxy-4-pyrimidin-2-ylbenzoyl)amino]-4-phenylbenzoic acid
CID 66990128
bis(3-phenyl-1H-pyrazol-5-yl)methanone
CID 174669259
2-[(3-methylpyridine-2-carbonyl)amino]-4-phenylbenzoic acid
CID 67343058
2-[(6-chloropyridine-3-carbonyl)amino]-4-phenylbenzoic acid
CID 87408033
4-phenyl-2-[(6-pyridin-4-ylpyridine-3-carbonyl)amino]benzoic acid
CID 58508716

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid?
The IUPAC name of 4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid (CID 67343979) is 4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid.
What is the SMILES notation for 4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid?
The canonical SMILES for 4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid is O=C(Nc1cc(-c2ccccc2)ccc1C(=O)O)c1cc(-c2ccccc2)n[nH]1.
What is the InChIKey of 4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid?
The InChIKey is BDWQDRVMOMZLKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N3O3/c27-22(21-14-19(25-26-21)16-9-5-2-6-10-16)24-20-13-17(11-12-18(20)23(28)29)15-7-3-1-4-8-15/h1-14H,(H,24,27)(H,25,26)(H,28,29).
What are the key properties of 4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid?
4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid has a molecular weight of 383.41 g/mol, XLogP of 4.69, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]benzoic acid is sourced from PubChem (CID 67343979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).