5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone
TL;DR: 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone (CAS 873663-54-8) is a chemical compound with molecular formula C9H8F3N3O and molecular weight 231.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-7-(trifluoromethyl)-3,4-dihydro-1H-quinoxalin-2-one
Also Known As: 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone, 5-Amino-7-trifluoromethyl-3,4-dihydro-1H-quinoxalin-2-one, 5-amino-7-(trifluoromethyl)-3,4-dihydro-1H-quinoxalin-2-one, 5-Amino-7-(trifluoromethyl)-3,4-dihydroquinoxalin-2(1H)-one, RefChem:300995
| Molecular Formula | C9H8F3N3O |
|---|---|
| Molecular Weight | 231.06 g/mol |
| LogP | 1.6516 |
| Topological Polar Surface Area | 67.15 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 231.06195 |
| Heavy Atoms | 16 |
| Complexity | 456.04782 |
Chemical Identifiers
| CAS Number | 873663-54-8 |
|---|---|
| SMILES | C1C(=O)NC2=CC(=CC(=C2N1)N)C(F)(F)F |
Product Overview
5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone (CAS 873663-54-8), with molecular formula C9H8F3N3O and molecular weight 231.06 g/mol. IUPAC: 5-amino-7-(trifluoromethyl)-3,4-dihydro-1H-quinoxalin-2-one.
Chemical Property Profile of 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone
Property Insights of 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone
The XLogP value of 1.6516 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone. The TPSA of 67.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone. Following Lipinski's Rule of Five, 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone has 3 hydrogen bond donor(s) and 3 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 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone?
The CAS number of 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone is 873663-54-8.
What is the molecular formula of 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone?
The molecular formula of 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone is C9H8F3N3O.
What is the molecular weight of 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone?
The molecular weight of 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone is 231.06 g/mol.
Where can I buy 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone?
You can request a quote for 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-3,4-dihydro-7-(trifluoromethyl)-2(1H)-quinoxalinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.