3-(5-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)pyridine
Chemical Structure Depiction of
3-(5-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)pyridine
3-(5-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)pyridine
Compound characteristics
| Compound ID: | Y206-1294 |
| Compound Name: | 3-(5-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)pyridine |
| Molecular Weight: | 348.83 |
| Molecular Formula: | C16 H14 Cl F N4 S |
| Smiles: | CCn1c(c2cccnc2)nnc1SCc1ccc(cc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 3.8506 |
| logD: | 3.8338 |
| logSw: | -4.1987 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.483 |
| InChI Key: | JKLYQORLBQSZCL-UHFFFAOYSA-N |