4-[2-chloro-5-(trifluoromethyl)phenyl]-5-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-[2-chloro-5-(trifluoromethyl)phenyl]-5-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
4-[2-chloro-5-(trifluoromethyl)phenyl]-5-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8017-7451 |
| Compound Name: | 4-[2-chloro-5-(trifluoromethyl)phenyl]-5-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 356.75 |
| Molecular Formula: | C14 H8 Cl F3 N4 S |
| Smiles: | c1cc(cnc1)c1nnc(n1c1cc(ccc1[Cl])C(F)(F)F)S |
| Stereo: | ACHIRAL |
| logP: | 3.1128 |
| logD: | 1.143 |
| logSw: | -3.5137 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.675 |
| InChI Key: | CVDMUTBHORLFTL-UHFFFAOYSA-N |