3-cyclohexyl-5-{[(3,4-dimethylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-cyclohexyl-5-{[(3,4-dimethylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
3-cyclohexyl-5-{[(3,4-dimethylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V002-7121 |
| Compound Name: | 3-cyclohexyl-5-{[(3,4-dimethylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazole |
| Molecular Weight: | 377.55 |
| Molecular Formula: | C23 H27 N3 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(CSc2nnc(C3CCCCC3)n2c2ccccc2)cc1C |
| Stereo: | ACHIRAL |
| logP: | 6.4579 |
| logD: | 6.4579 |
| logSw: | -5.6609 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.9046 |
| InChI Key: | BPPQOZAAIMMQPL-UHFFFAOYSA-N |