3-(2-chlorophenyl)-5-{[(3-chlorophenyl)methyl]sulfanyl}-4-(4-methylphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(2-chlorophenyl)-5-{[(3-chlorophenyl)methyl]sulfanyl}-4-(4-methylphenyl)-4H-1,2,4-triazole
3-(2-chlorophenyl)-5-{[(3-chlorophenyl)methyl]sulfanyl}-4-(4-methylphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | IB06-5704 |
| Compound Name: | 3-(2-chlorophenyl)-5-{[(3-chlorophenyl)methyl]sulfanyl}-4-(4-methylphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 426.37 |
| Molecular Formula: | C22 H17 Cl2 N3 S |
| Smiles: | Cc1ccc(cc1)n1c(c2ccccc2[Cl])nnc1SCc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.7 |
| logD: | 6.7 |
| logSw: | -7.3 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 59.17 |
| InChI Key: | AAFZRYDYXKAHOU-UHFFFAOYSA-N |