TL;DR: Pyridine, 2-(4-fluorophenyl)-4-(methylthio)-6-(2-(trifluoromethyl)phenyl)- (CAS 135689-23-5) is a chemical compound with molecular formula C19H13F4NS and molecular weight 363.0705 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-fluorophenyl)-4-methylsulfanyl-6-[2-(trifluoromethyl)phenyl]pyridine
Also Known As: Pyridine, 2-(4-fluorophenyl)-4-(methylthio)-6-(2-(trifluoromethyl)phenyl)-, 2-(4-fluorophenyl)-4-(methylsulfanyl)-6-[2-(trifluoromethyl)phenyl]pyridine, 2-(4-fluorophenyl)-4-methylsulfanyl-6-[2-(trifluoromethyl)phenyl]pyridine, 2-(4-Fluorophenyl)-4-methylthio-6-(2-(trifluoromethyl)phenyl)pyridine, Pyridine,2-(4-fluorophenyl)-4-(methylthio)-6-[2-(trifluoromethyl)phenyl]-
| Molecular Formula | C19H13F4NS |
| Molecular Weight | 363.0705 g/mol |
| XLogP | 5.7 |
| Topological Polar Surface Area (TPSA) | 38.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.0705 Da |
| Heavy Atoms | 25 |
| Complexity | 422.0 |
| SMILES | CSC1=CC(=NC(=C1)C2=CC=CC=C2C(F)(F)F)C3=CC=C(C=C3)F |
| InChIKey | QXCXMWLYXCBSHY-UHFFFAOYSA-N |
The XLogP value of 5.7 indicates that Pyridine, 2-(4-fluorophenyl)-4-(methylthio)-6-(2-(trifluoromethyl)phenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.2 Ų, Pyridine, 2-(4-fluorophenyl)-4-(methylthio)-6-(2-(trifluoromethyl)phenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridine, 2-(4-fluorophenyl)-4-(methylthio)-6-(2-(trifluoromethyl)phenyl)- has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Pyridine, 2-(4-fluorophenyl)-4-(methylthio)-6-(2-(trifluoromethyl)phenyl)- is 135689-23-5.
The molecular formula of Pyridine, 2-(4-fluorophenyl)-4-(methylthio)-6-(2-(trifluoromethyl)phenyl)- is C19H13F4NS.
The molecular weight of Pyridine, 2-(4-fluorophenyl)-4-(methylthio)-6-(2-(trifluoromethyl)phenyl)- is 363.0705 g/mol.
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