4-tert-butyl-N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-tert-butyl-N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide
4-tert-butyl-N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | G718-0877 |
| Compound Name: | 4-tert-butyl-N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide |
| Molecular Weight: | 412.55 |
| Molecular Formula: | C22 H28 N4 O2 S |
| Smiles: | Cc1ccc(Cc2nc(CCNS(c3ccc(cc3)C(C)(C)C)(=O)=O)n[nH]2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3656 |
| logD: | 5.3642 |
| logSw: | -5.4076 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.604 |
| InChI Key: | BEDCSHSLTQVRAW-UHFFFAOYSA-N |