N-{2-[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]ethyl}-4-(propan-2-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-{2-[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]ethyl}-4-(propan-2-yl)benzene-1-sulfonamide
N-{2-[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]ethyl}-4-(propan-2-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | G718-0654 |
| Compound Name: | N-{2-[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]ethyl}-4-(propan-2-yl)benzene-1-sulfonamide |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C20 H24 N4 O3 S |
| Smiles: | CC(C)c1ccc(cc1)S(NCCc1nc(c2ccc(cc2)OC)[nH]n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3719 |
| logD: | 4.3595 |
| logSw: | -4.2333 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.157 |
| InChI Key: | JYTUPKQIXSDKTB-UHFFFAOYSA-N |