3-[4-(5-chloro-2-methylphenyl)-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]pyridine
Chemical Structure Depiction of
3-[4-(5-chloro-2-methylphenyl)-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]pyridine
3-[4-(5-chloro-2-methylphenyl)-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]pyridine
Compound characteristics
| Compound ID: | V008-4913 |
| Compound Name: | 3-[4-(5-chloro-2-methylphenyl)-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]pyridine |
| Molecular Weight: | 406.94 |
| Molecular Formula: | C22 H19 Cl N4 S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1CSc1nnc(c2cccnc2)n1c1cc(ccc1C)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.7668 |
| logD: | 5.7626 |
| logSw: | -6.1029 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.929 |
| InChI Key: | LBWJZCRHBIUOFM-UHFFFAOYSA-N |