N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-2,4-dimethylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-2,4-dimethylbenzene-1-sulfonamide
N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-2,4-dimethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | G718-0737 |
| Compound Name: | N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-2,4-dimethylbenzene-1-sulfonamide |
| Molecular Weight: | 390.89 |
| Molecular Formula: | C18 H19 Cl N4 O2 S |
| Smiles: | Cc1ccc(c(C)c1)S(NCCc1nc(c2ccc(cc2)[Cl])[nH]n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4913 |
| logD: | 4.4789 |
| logSw: | -4.5567 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.614 |
| InChI Key: | WBQWTSDIJCSYRW-UHFFFAOYSA-N |