3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol
TL;DR: 3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol (CAS 98416-70-7) is a chemical compound with molecular formula C10H7F3N2O and molecular weight 228.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-6-(trifluoromethyl)-1H-quinoxalin-2-one
Also Known As: 3-methyl-6-(trifluoromethyl)quinoxalin-2-ol, NCI60_030780, 3-Methyl-6-(trifluoromethyl)-2-quinoxalinol, J1.127.955D, 3-methyl-6-(trifluoromethyl)-1H-quinoxalin-2-one
| Molecular Formula | C10H7F3N2O |
|---|---|
| Molecular Weight | 228.05 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 228.05104 |
| Heavy Atoms | 16 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 98416-70-7 |
|---|---|
| SMILES | CC1=NC2=C(C=CC(=C2)C(F)(F)F)NC1=O |
| InChIKey | ZCYLCBAIXBVSAF-UHFFFAOYSA-N |
Product Overview
3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol (CAS 98416-70-7), with molecular formula C10H7F3N2O and molecular weight 228.05 g/mol. IUPAC: 3-methyl-6-(trifluoromethyl)-1H-quinoxalin-2-one.
Chemical Property Profile of 3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol
Property Insights of 3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol. With a topological polar surface area (TPSA) of 41.5 Ų, 3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol has 1 hydrogen bond donor(s) and 5 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-Methyl-6-(trifluoromethyl)quinoxalin-2-ol?
The CAS number of 3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol is 98416-70-7.
What is the molecular formula of 3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol?
The molecular formula of 3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol is C10H7F3N2O.
What is the molecular weight of 3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol?
The molecular weight of 3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol is 228.05 g/mol.
Where can I buy 3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol?
You can request a quote for 3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-6-(trifluoromethyl)quinoxalin-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.