3-(2-chlorophenyl)-5-{[(3-methylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(2-chlorophenyl)-5-{[(3-methylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
3-(2-chlorophenyl)-5-{[(3-methylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V006-8042 |
| Compound Name: | 3-(2-chlorophenyl)-5-{[(3-methylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole |
| Molecular Weight: | 391.92 |
| Molecular Formula: | C22 H18 Cl N3 S |
| Smiles: | Cc1cccc(CSc2nnc(c3ccccc3[Cl])n2c2ccccc2)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.1463 |
| logD: | 6.1463 |
| logSw: | -6.2619 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.7125 |
| InChI Key: | IJLGSOICZVSZEW-UHFFFAOYSA-N |