2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid
TL;DR: 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid (CAS 293327-33-0) is a chemical compound with molecular formula C11H11N3O3 and molecular weight 233.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzoic acid
Also Known As: 2-amino-4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzoic Acid, 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid
| Molecular Formula | C11H11N3O3 |
|---|---|
| Molecular Weight | 233.08 g/mol |
| LogP | 1.0796 |
| Topological Polar Surface Area | 95.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.08005 |
| Heavy Atoms | 17 |
| Complexity | 536.76324 |
Chemical Identifiers
| CAS Number | 293327-33-0 |
|---|---|
| SMILES | CC1=NN(C(=O)C1)C2=CC(=C(C=C2)C(=O)O)N |
Product Overview
2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid (CAS 293327-33-0), with molecular formula C11H11N3O3 and molecular weight 233.08 g/mol. IUPAC: 2-amino-4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzoic acid.
Chemical Property Profile of 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid
Property Insights of 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid
The XLogP value of 1.0796 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid. The TPSA of 95.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid. Following Lipinski's Rule of Five, 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid has 2 hydrogen bond donor(s) and 4 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 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid?
The CAS number of 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid is 293327-33-0.
What is the molecular formula of 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid?
The molecular formula of 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid is C11H11N3O3.
What is the molecular weight of 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid?
The molecular weight of 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid is 233.08 g/mol.
Where can I buy 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid?
You can request a quote for 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.