5-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid
TL;DR: 5-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid (CAS 2048223-53-4) is a chemical compound with molecular formula C9H7N3O2 and molecular weight 189.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-pyridin-4-yl-1H-pyrazole-5-carboxylic acid
Also Known As: 5-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid, 5-Pyridin-4-yl-1H-pyrazole-3-carboxylic acid, 3-pyridin-4-yl-1H-pyrazole-5-carboxylic acid, 3-(pyridin-4-yl)-1H-pyrazole-5-carboxylic acid, 1H-Pyrazole-3-carboxylic acid, 5-(4-pyridinyl)-
| Molecular Formula | C9H7N3O2 |
|---|---|
| Molecular Weight | 189.05 g/mol |
| LogP | 1.1699 |
| Topological Polar Surface Area | 78.87 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.05383 |
| Heavy Atoms | 14 |
| Complexity | 450.09045 |
Chemical Identifiers
| CAS Number | 2048223-53-4 |
|---|---|
| SMILES | C1=CN=CC=C1C2=NNC(=C2)C(=O)O |
Product Overview
5-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid (CAS 2048223-53-4), with molecular formula C9H7N3O2 and molecular weight 189.05 g/mol. IUPAC: 3-pyridin-4-yl-1H-pyrazole-5-carboxylic acid.
Chemical Property Profile of 5-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid
Property Insights of 5-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid
The XLogP value of 1.1699 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid. The TPSA of 78.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid. Following Lipinski's Rule of Five, 5-(pyridin-4-yl)-1H-pyrazole-3-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-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid?
The CAS number of 5-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid is 2048223-53-4.
What is the molecular formula of 5-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid?
The molecular formula of 5-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid is C9H7N3O2.
What is the molecular weight of 5-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid?
The molecular weight of 5-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid is 189.05 g/mol.
Where can I buy 5-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid?
You can request a quote for 5-(pyridin-4-yl)-1H-pyrazole-3-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-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(pyridin-4-yl)-1H-pyrazole-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.