![4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid structure](/static/products/4924/492457-63-3.webp)
4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid
TL;DR: 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid (CAS 492457-63-3) is a chemical compound with molecular formula C13H13N3O3 and molecular weight 259.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(1,5-dimethylpyrazole-4-carbonyl)amino]benzoic acid
Also Known As: ChemDiv2_001483, 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid, 4-[(1,5-dimethylpyrazole-4-carbonyl)amino]benzoic acid, 4-(1,5-dimethyl-1H-pyrazole-4-carboxamido)benzoic acid, 4-[(1,5-dimethylpyrazol-4-yl)carbonylamino]benzoic acid
| Molecular Formula | C13H13N3O3 |
|---|---|
| Molecular Weight | 259.10 g/mol |
| LogP | 1.67902 |
| Topological Polar Surface Area | 84.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.0957 |
| Heavy Atoms | 19 |
| Complexity | 629.08307 |
Chemical Identifiers
| CAS Number | 492457-63-3 |
|---|---|
| SMILES | CC1=C(C=NN1C)C(=O)NC2=CC=C(C=C2)C(=O)O |
Product Overview
4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid (CAS 492457-63-3), with molecular formula C13H13N3O3 and molecular weight 259.10 g/mol. IUPAC: 4-[(1,5-dimethylpyrazole-4-carbonyl)amino]benzoic acid.
Chemical Property Profile of 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid
Property Insights of 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid
The XLogP value of 1.67902 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid. The TPSA of 84.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid. Following Lipinski's Rule of Five, 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid?
The CAS number of 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid is 492457-63-3.
What is the molecular formula of 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid?
The molecular formula of 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid is C13H13N3O3.
What is the molecular weight of 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid?
The molecular weight of 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid is 259.10 g/mol.
Where can I buy 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid?
You can request a quote for 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(1,5-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.