N-(2-{5-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-4-(propan-2-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-(2-{5-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-4-(propan-2-yl)benzene-1-sulfonamide
N-(2-{5-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-4-(propan-2-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | G718-1347 |
| Compound Name: | N-(2-{5-[(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-4-(propan-2-yl)benzene-1-sulfonamide |
| Molecular Weight: | 398.53 |
| Molecular Formula: | C21 H26 N4 O2 S |
| Smiles: | CC(C)c1ccc(cc1)S(NCCc1nc(Cc2cccc(C)c2)[nH]n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1781 |
| logD: | 5.1767 |
| logSw: | -5.1022 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.604 |
| InChI Key: | PDCKZUAKHATAPW-UHFFFAOYSA-N |