N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-4-(2-methylpropyl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-4-(2-methylpropyl)benzene-1-sulfonamide
N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-4-(2-methylpropyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | G718-0744 |
| Compound Name: | N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-4-(2-methylpropyl)benzene-1-sulfonamide |
| Molecular Weight: | 418.94 |
| Molecular Formula: | C20 H23 Cl N4 O2 S |
| Smiles: | CC(C)Cc1ccc(cc1)S(NCCc1nc(c2ccc(cc2)[Cl])[nH]n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3265 |
| logD: | 5.3141 |
| logSw: | -6.113 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.614 |
| InChI Key: | XQOXNZHDDMEWNK-UHFFFAOYSA-N |