6,7-difluoro-3-methyl-1H-quinoxalin-2-one
TL;DR: 6,7-difluoro-3-methyl-1H-quinoxalin-2-one (CAS 230953-87-4) is a chemical compound with molecular formula C9H6F2N2O and molecular weight 196.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-difluoro-3-methyl-1H-quinoxalin-2-one
Also Known As: 6,7-difluoro-3-methyl-1H-quinoxalin-2-one, 6,7-Difluoro-3-methyl-2-quinoxalinol, 6,7-difluoro-3-methyl-quinoxalin-2-ol, 6,7-difluoro-3-methylquinoxalin-2(1h)-one, NCI60_030779
| Molecular Formula | C9H6F2N2O |
|---|---|
| Molecular Weight | 196.04 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 196.04482 |
| Heavy Atoms | 14 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 230953-87-4 |
|---|---|
| SMILES | CC1=NC2=CC(=C(C=C2NC1=O)F)F |
| InChIKey | FMOBBPRFTMLFEM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6,7-difluoro-3-methyl-1H-quinoxalin-2-one (CAS 230953-87-4), with molecular formula C9H6F2N2O and molecular weight 196.04 g/mol. IUPAC: 6,7-difluoro-3-methyl-1H-quinoxalin-2-one.
Chemical Property Profile of 6,7-difluoro-3-methyl-1H-quinoxalin-2-one
Property Insights of 6,7-difluoro-3-methyl-1H-quinoxalin-2-one
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-difluoro-3-methyl-1H-quinoxalin-2-one. With a topological polar surface area (TPSA) of 41.5 Ų, 6,7-difluoro-3-methyl-1H-quinoxalin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-difluoro-3-methyl-1H-quinoxalin-2-one 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 6,7-difluoro-3-methyl-1H-quinoxalin-2-one?
The CAS number of 6,7-difluoro-3-methyl-1H-quinoxalin-2-one is 230953-87-4.
What is the molecular formula of 6,7-difluoro-3-methyl-1H-quinoxalin-2-one?
The molecular formula of 6,7-difluoro-3-methyl-1H-quinoxalin-2-one is C9H6F2N2O.
What is the molecular weight of 6,7-difluoro-3-methyl-1H-quinoxalin-2-one?
The molecular weight of 6,7-difluoro-3-methyl-1H-quinoxalin-2-one is 196.04 g/mol.
Where can I buy 6,7-difluoro-3-methyl-1H-quinoxalin-2-one?
You can request a quote for 6,7-difluoro-3-methyl-1H-quinoxalin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-difluoro-3-methyl-1H-quinoxalin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6,7-difluoro-3-methyl-1H-quinoxalin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.