1-(benzenesulfonyl)-3-{4-(2,5-dimethoxyphenyl)-5-[(3-phenylprop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazol-3-yl}-1H-indole
Chemical Structure Depiction of
1-(benzenesulfonyl)-3-{4-(2,5-dimethoxyphenyl)-5-[(3-phenylprop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazol-3-yl}-1H-indole
1-(benzenesulfonyl)-3-{4-(2,5-dimethoxyphenyl)-5-[(3-phenylprop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazol-3-yl}-1H-indole
Compound characteristics
| Compound ID: | S322-0330 |
| Compound Name: | 1-(benzenesulfonyl)-3-{4-(2,5-dimethoxyphenyl)-5-[(3-phenylprop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazol-3-yl}-1H-indole |
| Molecular Weight: | 608.74 |
| Molecular Formula: | C33 H28 N4 O4 S2 |
| Smiles: | COc1ccc(c(c1)n1c(c2cn(c3ccccc23)S(c2ccccc2)(=O)=O)nnc1SC/C=C/c1ccccc1)OC |
| Stereo: | ACHIRAL |
| logP: | 7.0325 |
| logD: | 7.0325 |
| logSw: | -5.9389 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.579 |
| InChI Key: | OKKYLWINPILUJJ-UHFFFAOYSA-N |