3-[5-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-(2-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyridine
Chemical Structure Depiction of
3-[5-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-(2-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyridine
3-[5-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-(2-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyridine
Compound characteristics
| Compound ID: | V011-4954 |
| Compound Name: | 3-[5-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-(2-fluorophenyl)-4H-1,2,4-triazol-3-yl]pyridine |
| Molecular Weight: | 414.86 |
| Molecular Formula: | C20 H13 Cl F2 N4 S |
| Smiles: | C(c1c(cccc1[Cl])F)Sc1nnc(c2cccnc2)n1c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 4.6116 |
| logD: | 4.6075 |
| logSw: | -4.8481 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.929 |
| InChI Key: | DNXMEWCILSBPLY-UHFFFAOYSA-N |