ethyl 5-(acetyloxy)-6-bromo-2-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}-1-methyl-1H-indole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(acetyloxy)-6-bromo-2-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}-1-methyl-1H-indole-3-carboxylate
ethyl 5-(acetyloxy)-6-bromo-2-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}-1-methyl-1H-indole-3-carboxylate
Compound characteristics
| Compound ID: | 8008-9747 |
| Compound Name: | ethyl 5-(acetyloxy)-6-bromo-2-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}-1-methyl-1H-indole-3-carboxylate |
| Molecular Weight: | 516.41 |
| Molecular Formula: | C23 H22 Br N3 O4 S |
| Smiles: | CCOC(c1c2cc(c(cc2n(C)c1CSc1c(C#N)c(C)cc(C)n1)[Br])OC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5429 |
| logD: | 4.5429 |
| logSw: | -4.442 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.961 |
| InChI Key: | FEKTXJRLVJYRHH-UHFFFAOYSA-N |