N-(2,6-dimethylphenyl)-2-({4-(3-methylphenyl)-5-[(phenylsulfanyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-2-({4-(3-methylphenyl)-5-[(phenylsulfanyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
N-(2,6-dimethylphenyl)-2-({4-(3-methylphenyl)-5-[(phenylsulfanyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | 8014-3317 |
| Compound Name: | N-(2,6-dimethylphenyl)-2-({4-(3-methylphenyl)-5-[(phenylsulfanyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 474.65 |
| Molecular Formula: | C26 H26 N4 O S2 |
| Smiles: | Cc1cccc(c1)n1c(CSc2ccccc2)nnc1SCC(Nc1c(C)cccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.334 |
| logD: | 5.334 |
| logSw: | -5.2526 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.442 |
| InChI Key: | VDRCWJBBBYLULM-UHFFFAOYSA-N |