3-cyano-N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide
Chemical Structure Depiction of
3-cyano-N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide
3-cyano-N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | G718-0944 |
| Compound Name: | 3-cyano-N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide |
| Molecular Weight: | 381.45 |
| Molecular Formula: | C19 H19 N5 O2 S |
| Smiles: | Cc1ccc(Cc2nc(CCNS(c3cccc(C#N)c3)(=O)=O)n[nH]2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1158 |
| logD: | 3.1144 |
| logSw: | -3.408 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.66 |
| InChI Key: | LXTYJWARSFPZKC-UHFFFAOYSA-N |