6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid
TL;DR: 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid (CAS 1023839-36-2) is a chemical compound with molecular formula C16H10N4O2 and molecular weight 290.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[1-(4-cyanophenyl)pyrazol-4-yl]pyridine-3-carboxylic acid
Also Known As: 6-[1-(4-cyanophenyl)pyrazol-4-yl]pyridine-3-carboxylic Acid, 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid
| Molecular Formula | C16H10N4O2 |
|---|---|
| Molecular Weight | 290.08 g/mol |
| LogP | 2.50418 |
| Topological Polar Surface Area | 91.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.08038 |
| Heavy Atoms | 22 |
| Complexity | 858.4115 |
Chemical Identifiers
| CAS Number | 1023839-36-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C#N)N2C=C(C=N2)C3=NC=C(C=C3)C(=O)O |
Product Overview
6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid (CAS 1023839-36-2), with molecular formula C16H10N4O2 and molecular weight 290.08 g/mol. IUPAC: 6-[1-(4-cyanophenyl)pyrazol-4-yl]pyridine-3-carboxylic acid.
Chemical Property Profile of 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid
Property Insights of 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid
The XLogP value of 2.50418 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid. The TPSA of 91.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid. Following Lipinski's Rule of Five, 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid has 1 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 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid?
The CAS number of 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid is 1023839-36-2.
What is the molecular formula of 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid?
The molecular formula of 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid is C16H10N4O2.
What is the molecular weight of 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid?
The molecular weight of 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid is 290.08 g/mol.
Where can I buy 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid?
You can request a quote for 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-(1-(4-Cyanophenyl)-1H-pyrazol-4-yl)nicotinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.