8-(Trifluoromethyl)quinoline-4-thiol
TL;DR: 8-(Trifluoromethyl)quinoline-4-thiol (CAS 550346-16-2) is a chemical compound with molecular formula C10H6F3NS and molecular weight 229.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(trifluoromethyl)-1H-quinoline-4-thione
Also Known As: 8-(Trifluoromethyl)quinoline-4-thiol, 4-Mercapto-8-(trifluoromethyl)quinoline, 8-(trifluoromethyl)-1H-quinoline-4-thione, 4-Quinolinethiol, 8-(trifluoromethyl)-, 8-Trifluoromethyl-1H-quinoline-4-thione
| Molecular Formula | C10H6F3NS |
|---|---|
| Molecular Weight | 229.02 g/mol |
| LogP | 3.91619 |
| Topological Polar Surface Area | 15.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 229.0173 |
| Heavy Atoms | 15 |
| Complexity | 556.3314 |
Chemical Identifiers
| CAS Number | 550346-16-2 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)C(F)(F)F)NC=CC2=S |
Product Overview
8-(Trifluoromethyl)quinoline-4-thiol (CAS 550346-16-2), with molecular formula C10H6F3NS and molecular weight 229.02 g/mol. IUPAC: 8-(trifluoromethyl)-1H-quinoline-4-thione.
Chemical Property Profile of 8-(Trifluoromethyl)quinoline-4-thiol
Property Insights of 8-(Trifluoromethyl)quinoline-4-thiol
The XLogP value of 3.91619 indicates that 8-(Trifluoromethyl)quinoline-4-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.79 Ų, 8-(Trifluoromethyl)quinoline-4-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-(Trifluoromethyl)quinoline-4-thiol has 1 hydrogen bond donor(s) and 1 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 8-(Trifluoromethyl)quinoline-4-thiol?
The CAS number of 8-(Trifluoromethyl)quinoline-4-thiol is 550346-16-2.
What is the molecular formula of 8-(Trifluoromethyl)quinoline-4-thiol?
The molecular formula of 8-(Trifluoromethyl)quinoline-4-thiol is C10H6F3NS.
What is the molecular weight of 8-(Trifluoromethyl)quinoline-4-thiol?
The molecular weight of 8-(Trifluoromethyl)quinoline-4-thiol is 229.02 g/mol.
Where can I buy 8-(Trifluoromethyl)quinoline-4-thiol?
You can request a quote for 8-(Trifluoromethyl)quinoline-4-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(Trifluoromethyl)quinoline-4-thiol?
Yes, KEHONG BIO provides custom synthesis services for 8-(Trifluoromethyl)quinoline-4-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.