2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)-
TL;DR: 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)- (CAS 127183-42-0) is a chemical compound with molecular formula C13H7F6NOS and molecular weight 339.01526 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1,1-trifluoro-3-[7-(trifluoromethyl)quinolin-4-yl]sulfanylpropan-2-one
Also Known As: 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)-, 1,1,1-trifluoro-3-[7-(trifluoromethyl)quinolin-4-yl]sulfanyl-propan-2-one, 1,1,1-trifluoro-3-[7-(trifluoromethyl)quinolin-4-yl]sulfanylpropan-2-one, 1,1,1-TRIFLUORO-3-{[7-(TRIFLUOROMETHYL)QUINOLIN-4-YL]SULFANYL}PROPAN-2-ONE
Technical Specifications
| Molecular Formula | C13H7F6NOS |
| Molecular Weight | 339.01526 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 55.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.01526 Da |
| Heavy Atoms | 22 |
| Complexity | 410.0 |
| SMILES | C1=CC2=C(C=CN=C2C=C1C(F)(F)F)SCC(=O)C(F)(F)F |
| InChIKey | KTJBRQFYWRFGSC-UHFFFAOYSA-N |
Chemical Property Profile of 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)-
Property Insights of 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)-
The XLogP value of 3.8 indicates that 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.3 Ų, 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)- has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)-?
The CAS number of 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)- is 127183-42-0.
What is the molecular formula of 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)-?
The molecular formula of 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)- is C13H7F6NOS.
What is the molecular weight of 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)-?
The molecular weight of 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)- is 339.01526 g/mol.
Where can I buy 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)-?
You can request a quote for 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)-?
Yes, CoreyChem provides custom synthesis services for 2-Propanone, 1,1,1-trifluoro-3-((7-(trifluoromethyl)-4-quinolinyl)thio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.