![2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline structure](/static/products/3389/338977-86-9.webp)
2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline
TL;DR: 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline (CAS 338977-86-9) is a chemical compound with molecular formula C16H11F3N2S and molecular weight 320.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinoxaline
Also Known As: 2-{[3-(trifluoromethyl)benzyl]sulfanyl}quinoxaline, 9E-402S, 2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinoxaline, 2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)quinoxaline
| Molecular Formula | C16H11F3N2S |
|---|---|
| Molecular Weight | 320.06 g/mol |
| LogP | 4.9409 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.0595 |
| Heavy Atoms | 22 |
| Complexity | 802.4979 |
Chemical Identifiers
| CAS Number | 338977-86-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=CC(=N2)SCC3=CC(=CC=C3)C(F)(F)F |
Product Overview
2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline (CAS 338977-86-9), with molecular formula C16H11F3N2S and molecular weight 320.06 g/mol. IUPAC: 2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinoxaline.
Chemical Property Profile of 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline
Property Insights of 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline
The XLogP value of 4.9409 indicates that 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline has 0 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 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline?
The CAS number of 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline is 338977-86-9.
What is the molecular formula of 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline?
The molecular formula of 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline is C16H11F3N2S.
What is the molecular weight of 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline?
The molecular weight of 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline is 320.06 g/mol.
Where can I buy 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline?
You can request a quote for 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline?
Yes, KEHONG BIO provides custom synthesis services for 2-{[3-(Trifluoromethyl)benzyl]sulfanyl}quinoxaline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.