3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-methyl-4-(2-methylphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-methyl-4-(2-methylphenyl)-4H-1,2,4-triazole
3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-methyl-4-(2-methylphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V011-6117 |
| Compound Name: | 3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-methyl-4-(2-methylphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 347.84 |
| Molecular Formula: | C17 H15 Cl F N3 S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1n1c(C)nnc1SCc1c(cccc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 4.3488 |
| logD: | 4.3488 |
| logSw: | -4.4353 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.4601 |
| InChI Key: | FRLAPAMGCLNYNQ-UHFFFAOYSA-N |