3-(5-{[(4-methoxyphenyl)methyl]sulfanyl}-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl)pyridine
Chemical Structure Depiction of
3-(5-{[(4-methoxyphenyl)methyl]sulfanyl}-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl)pyridine
3-(5-{[(4-methoxyphenyl)methyl]sulfanyl}-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl)pyridine
Compound characteristics
| Compound ID: | V010-9142 |
| Compound Name: | 3-(5-{[(4-methoxyphenyl)methyl]sulfanyl}-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl)pyridine |
| Molecular Weight: | 442.46 |
| Molecular Formula: | C22 H17 F3 N4 O S |
| Salt: | not_available |
| Smiles: | COc1ccc(CSc2nnc(c3cccnc3)n2c2cccc(c2)C(F)(F)F)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4397 |
| logD: | 4.4355 |
| logSw: | -4.2541 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.774 |
| InChI Key: | IUZICVBWFGTAKN-UHFFFAOYSA-N |