1-(benzenesulfonyl)-3-[5-(butylsulfanyl)-4-(2,5-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl]-1H-indole
Chemical Structure Depiction of
1-(benzenesulfonyl)-3-[5-(butylsulfanyl)-4-(2,5-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl]-1H-indole
1-(benzenesulfonyl)-3-[5-(butylsulfanyl)-4-(2,5-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl]-1H-indole
Compound characteristics
| Compound ID: | S322-0186 |
| Compound Name: | 1-(benzenesulfonyl)-3-[5-(butylsulfanyl)-4-(2,5-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl]-1H-indole |
| Molecular Weight: | 548.68 |
| Molecular Formula: | C28 H28 N4 O4 S2 |
| Smiles: | CCCCSc1nnc(c2cn(c3ccccc23)S(c2ccccc2)(=O)=O)n1c1cc(ccc1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 6.2487 |
| logD: | 6.2487 |
| logSw: | -5.7321 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.85 |
| InChI Key: | LIPYVAZNDRQTPE-UHFFFAOYSA-N |