3-cyclohexyl-5-{[(3,4-dimethylphenyl)methyl]sulfanyl}-4-(3-methylphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-cyclohexyl-5-{[(3,4-dimethylphenyl)methyl]sulfanyl}-4-(3-methylphenyl)-4H-1,2,4-triazole
3-cyclohexyl-5-{[(3,4-dimethylphenyl)methyl]sulfanyl}-4-(3-methylphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V002-6890 |
| Compound Name: | 3-cyclohexyl-5-{[(3,4-dimethylphenyl)methyl]sulfanyl}-4-(3-methylphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 391.58 |
| Molecular Formula: | C24 H29 N3 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)n1c(C2CCCCC2)nnc1SCc1ccc(C)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 7.0471 |
| logD: | 7.0471 |
| logSw: | -5.6549 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.9046 |
| InChI Key: | NSXKCDAYXVIYII-UHFFFAOYSA-N |