ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate
TL;DR: ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate (CAS 76179-41-4) is a chemical compound with molecular formula C11H8F2N2O3 and molecular weight 254.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate
Also Known As: ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate, J1.019.255B, ethyl 6,7-difluoro-3-hydroxyquinoxaline-2-carboxylate, ethyl 6,7-difluoro-3-oxo-3,4-dihydroquinoxaline-2-carboxylate, 2-Quinoxalinecarboxylic acid, 6,7-difluoro-3,4-dihydro-3-oxo-, ethyl ester
| Molecular Formula | C11H8F2N2O3 |
|---|---|
| Molecular Weight | 254.05 g/mol |
| LogP | 1.378 |
| Topological Polar Surface Area | 72.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.0503 |
| Heavy Atoms | 18 |
| Complexity | 681.778 |
Chemical Identifiers
| CAS Number | 76179-41-4 |
|---|---|
| SMILES | CCOC(=O)C1=NC2=CC(=C(C=C2NC1=O)F)F |
Product Overview
ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate (CAS 76179-41-4), with molecular formula C11H8F2N2O3 and molecular weight 254.05 g/mol. IUPAC: ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate.
Chemical Property Profile of ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate
Property Insights of ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate
The XLogP value of 1.378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate. The TPSA of 72.05 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate. Following Lipinski's Rule of Five, ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate 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 ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate?
The CAS number of ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate is 76179-41-4.
What is the molecular formula of ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate?
The molecular formula of ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate is C11H8F2N2O3.
What is the molecular weight of ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate?
The molecular weight of ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate is 254.05 g/mol.
Where can I buy ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate?
You can request a quote for ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 6,7-difluoro-3-oxo-4H-quinoxaline-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.