5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid
TL;DR: 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid (CAS 19867-63-1) is a chemical compound with molecular formula C11H11N3O2 and molecular weight 217.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-1-benzylpyrazole-4-carboxylic acid
Also Known As: 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid, 5-amino-1-benzylpyrazole-4-carboxylic acid, 5-Amino-1-benzyl-1H-pyrazole-4-carboxylicacid, 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(phenylmethyl)-, 5-amino-1-benzyl-pyrazole-4-carboxylic Acid
| Molecular Formula | C11H11N3O2 |
|---|---|
| Molecular Weight | 217.09 g/mol |
| LogP | 1.2118 |
| Topological Polar Surface Area | 81.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 217.08513 |
| Heavy Atoms | 16 |
| Complexity | 505.20316 |
Chemical Identifiers
| CAS Number | 19867-63-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=C(C=N2)C(=O)O)N |
Product Overview
5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid (CAS 19867-63-1), with molecular formula C11H11N3O2 and molecular weight 217.09 g/mol. IUPAC: 5-amino-1-benzylpyrazole-4-carboxylic acid.
Chemical Property Profile of 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid
Property Insights of 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid
The XLogP value of 1.2118 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid. The TPSA of 81.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid. Following Lipinski's Rule of Five, 5-amino-1-benzyl-1H-pyrazole-4-carboxylic 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 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid?
The CAS number of 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid is 19867-63-1.
What is the molecular formula of 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid?
The molecular formula of 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid is C11H11N3O2.
What is the molecular weight of 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid?
The molecular weight of 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid is 217.09 g/mol.
Where can I buy 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid?
You can request a quote for 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-amino-1-benzyl-1H-pyrazole-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.