犬尿喹啉酸
TL;DR: 犬尿喹啉酸 (CAS 492-27-3) is a chemical compound with molecular formula C10H7NO3 and molecular weight 189.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
犬尿喹啉酸
4-oxo-1H-quinoline-2-carboxylic acid
Also Known As: kynurenic acid, Transtorine, 4-Hydroxyquinoline-2-carboxylic acid, Kynurenate, Quinurenic acid
| Molecular Formula | C10H7NO3 |
|---|---|
| Molecular Weight | 189.04 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.04259 |
| Heavy Atoms | 14 |
| Complexity | 308.0 |
| Melting Point | 280 °C |
| Solubility | >28.4 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 492-27-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C=C(N2)C(=O)O |
| InChIKey | HCZHHEIFKROPDY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
犬尿喹啉酸 (CAS 492-27-3), with molecular formula C10H7NO3 and molecular weight 189.04 g/mol. IUPAC: 4-oxo-1H-quinoline-2-carboxylic acid.
Chemical Property Profile of 犬尿喹啉酸
Property Insights of 犬尿喹啉酸
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 犬尿喹啉酸. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 犬尿喹啉酸. Following Lipinski's Rule of Five, 犬尿喹啉酸 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 犬尿喹啉酸?
The CAS number of 犬尿喹啉酸 is 492-27-3.
What is the molecular formula of 犬尿喹啉酸?
The molecular formula of 犬尿喹啉酸 is C10H7NO3.
What is the molecular weight of 犬尿喹啉酸?
The molecular weight of 犬尿喹啉酸 is 189.04 g/mol.
Where can I buy 犬尿喹啉酸?
You can request a quote for 犬尿喹啉酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 犬尿喹啉酸?
Yes, KEHONG BIO provides custom synthesis services for 犬尿喹啉酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.