ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-{[(4-methylphenyl)sulfanyl]methyl}-1H-indole-3-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-{[(4-methylphenyl)sulfanyl]methyl}-1H-indole-3-carboxylate--hydrogen chloride (1/1)
ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-{[(4-methylphenyl)sulfanyl]methyl}-1H-indole-3-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 4546-0081 |
| Compound Name: | ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-{[(4-methylphenyl)sulfanyl]methyl}-1H-indole-3-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 527.91 |
| Molecular Formula: | C23 H27 Br N2 O3 S |
| Salt: | HCl |
| Smiles: | CCOC(c1c2c(CN(C)C)c(c(cc2n(C)c1CSc1ccc(C)cc1)[Br])O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1669 |
| logD: | 3.7036 |
| logSw: | -5.1247 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.88 |
| InChI Key: | VLSGAOYACVQQIC-UHFFFAOYSA-N |