N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-2,4,6-trimethylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-2,4,6-trimethylbenzene-1-sulfonamide
N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-2,4,6-trimethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | G718-0694 |
| Compound Name: | N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-2,4,6-trimethylbenzene-1-sulfonamide |
| Molecular Weight: | 404.92 |
| Molecular Formula: | C19 H21 Cl N4 O2 S |
| Smiles: | Cc1cc(C)c(c(C)c1)S(NCCc1nc(c2ccc(cc2)[Cl])[nH]n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8649 |
| logD: | 4.8525 |
| logSw: | -4.8246 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.614 |
| InChI Key: | FQRQDQKXKIKUOZ-UHFFFAOYSA-N |