N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-4-(2-methylpropyl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-4-(2-methylpropyl)benzene-1-sulfonamide
N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-4-(2-methylpropyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | G718-0916 |
| Compound Name: | N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-4-(2-methylpropyl)benzene-1-sulfonamide |
| Molecular Weight: | 412.55 |
| Molecular Formula: | C22 H28 N4 O2 S |
| Smiles: | CC(C)Cc1ccc(cc1)S(NCCc1nc(Cc2ccc(C)cc2)[nH]n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2516 |
| logD: | 5.2502 |
| logSw: | -5.1198 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.604 |
| InChI Key: | GPUCYMBYRISSMF-UHFFFAOYSA-N |