1-(benzenesulfonyl)-3-{5-[(butan-2-yl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}-1H-indole
Chemical Structure Depiction of
1-(benzenesulfonyl)-3-{5-[(butan-2-yl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}-1H-indole
1-(benzenesulfonyl)-3-{5-[(butan-2-yl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}-1H-indole
Compound characteristics
| Compound ID: | S322-0139 |
| Compound Name: | 1-(benzenesulfonyl)-3-{5-[(butan-2-yl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}-1H-indole |
| Molecular Weight: | 440.59 |
| Molecular Formula: | C22 H24 N4 O2 S2 |
| Smiles: | CCC(C)Sc1nnc(c2cn(c3ccccc23)S(c2ccccc2)(=O)=O)n1CC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0219 |
| logD: | 5.0219 |
| logSw: | -4.7109 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.23 |
| InChI Key: | ISPPTXPETFPMPC-INIZCTEOSA-N |