3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(2-chlorophenyl)-4-(2-methoxyphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(2-chlorophenyl)-4-(2-methoxyphenyl)-4H-1,2,4-triazole
3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(2-chlorophenyl)-4-(2-methoxyphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V010-9274 |
| Compound Name: | 3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(2-chlorophenyl)-4-(2-methoxyphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 460.36 |
| Molecular Formula: | C22 H16 Cl2 F N3 O S |
| Salt: | not_available |
| Smiles: | COc1ccccc1n1c(c2ccccc2[Cl])nnc1SCc1c(cccc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 6.1472 |
| logD: | 6.1472 |
| logSw: | -6.1293 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.042 |
| InChI Key: | HKJHCYMTHILAOQ-UHFFFAOYSA-N |