2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine
TL;DR: 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine (CAS 175203-50-6) is a chemical compound with molecular formula C12H11F3N2S and molecular weight 272.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethanamine
Also Known As: Maybridge1_004825, 2-{[2-(Trifluoromethyl)-4-quinolyl]thio}ethylamine, 2-((2-(Trifluoromethyl)quinolin-4-yl)thio)ethanamine, PC1070V, BUTTPARK 46\04-42
| Molecular Formula | C12H11F3N2S |
|---|---|
| Molecular Weight | 272.06 g/mol |
| LogP | 3.3044 |
| Topological Polar Surface Area | 38.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.0595 |
| Heavy Atoms | 18 |
| Complexity | 554.5041 |
Chemical Identifiers
| CAS Number | 175203-50-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC(=N2)C(F)(F)F)SCCN |
Product Overview
2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine (CAS 175203-50-6), with molecular formula C12H11F3N2S and molecular weight 272.06 g/mol. IUPAC: 2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethanamine.
Chemical Property Profile of 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine
Property Insights of 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine
The XLogP value of 3.3044 indicates that 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.91 Ų, 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine has 1 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-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine?
The CAS number of 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine is 175203-50-6.
What is the molecular formula of 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine?
The molecular formula of 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine is C12H11F3N2S.
What is the molecular weight of 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine?
The molecular weight of 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine is 272.06 g/mol.
Where can I buy 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine?
You can request a quote for 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine?
Yes, KEHONG BIO provides custom synthesis services for 2-[[2-(Trifluoromethyl)-4-quinolinyl]thio]ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.