3-Phenylquinoxaline-6-carboxylic acid
TL;DR: 3-Phenylquinoxaline-6-carboxylic acid (CAS 104007-44-5) is a chemical compound with molecular formula C15H10N2O2 and molecular weight 250.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenylquinoxaline-6-carboxylic acid
Also Known As: 3-phenylquinoxaline-6-carboxylic acid, 6-Quinoxalinecarboxylic acid, 3-phenyl-, 6-Quinoxalinecarboxylic acid,3-phenyl
| Molecular Formula | C15H10N2O2 |
|---|---|
| Molecular Weight | 250.07 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 63.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.07423 |
| Heavy Atoms | 19 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 104007-44-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CN=C3C=CC(=CC3=N2)C(=O)O |
| InChIKey | XKRNBOKUBHFPAA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Phenylquinoxaline-6-carboxylic acid (CAS 104007-44-5), with molecular formula C15H10N2O2 and molecular weight 250.07 g/mol. IUPAC: 3-phenylquinoxaline-6-carboxylic acid.
Chemical Property Profile of 3-Phenylquinoxaline-6-carboxylic acid
Property Insights of 3-Phenylquinoxaline-6-carboxylic acid
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenylquinoxaline-6-carboxylic acid. The TPSA of 63.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Phenylquinoxaline-6-carboxylic acid. Following Lipinski's Rule of Five, 3-Phenylquinoxaline-6-carboxylic 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 3-Phenylquinoxaline-6-carboxylic acid?
The CAS number of 3-Phenylquinoxaline-6-carboxylic acid is 104007-44-5.
What is the molecular formula of 3-Phenylquinoxaline-6-carboxylic acid?
The molecular formula of 3-Phenylquinoxaline-6-carboxylic acid is C15H10N2O2.
What is the molecular weight of 3-Phenylquinoxaline-6-carboxylic acid?
The molecular weight of 3-Phenylquinoxaline-6-carboxylic acid is 250.07 g/mol.
Where can I buy 3-Phenylquinoxaline-6-carboxylic acid?
You can request a quote for 3-Phenylquinoxaline-6-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenylquinoxaline-6-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenylquinoxaline-6-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.