2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid
TL;DR: 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid (CAS 380489-22-5) is a chemical compound with molecular formula C34H22N6O3 and molecular weight 562.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(2-oxochromen-3-yl)-1-phenylpyrazol-4-yl]methylideneamino]-2-pyridin-2-ylquinoline-4-carboxamide
Also Known As: 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid, N-[[3-(2-oxochromen-3-yl)-1-phenylpyrazol-4-yl]methylideneamino]-2-pyridin-2-ylquinoline-4-carboxamide
| Molecular Formula | C34H22N6O3 |
|---|---|
| Molecular Weight | 562.18 g/mol |
| LogP | 6.0198 |
| Topological Polar Surface Area | 115.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 562.17535 |
| Heavy Atoms | 43 |
| Complexity | 2205.59 |
Chemical Identifiers
| CAS Number | 380489-22-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4OC3=O)C=NNC(=O)C5=CC(=NC6=CC=CC=C65)C7=CC=CC=N7 |
Product Overview
2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid (CAS 380489-22-5), with molecular formula C34H22N6O3 and molecular weight 562.18 g/mol. IUPAC: N-[[3-(2-oxochromen-3-yl)-1-phenylpyrazol-4-yl]methylideneamino]-2-pyridin-2-ylquinoline-4-carboxamide.
Chemical Property Profile of 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid
Property Insights of 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid
The XLogP value of 6.0198 indicates that 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid. Following Lipinski's Rule of Five, 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid?
The CAS number of 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid is 380489-22-5.
What is the molecular formula of 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid?
The molecular formula of 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid is C34H22N6O3.
What is the molecular weight of 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid?
The molecular weight of 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid is 562.18 g/mol.
Where can I buy 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid?
You can request a quote for 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-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 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.