ethyl 1-benzyl-6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 1-benzyl-6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate--hydrogen chloride (1/1)
ethyl 1-benzyl-6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 3474-0087 |
| Compound Name: | ethyl 1-benzyl-6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 589.98 |
| Molecular Formula: | C28 H29 Br N2 O3 S |
| Salt: | HCl |
| Smiles: | CCOC(c1c2c(CN(C)C)c(c(cc2n(Cc2ccccc2)c1CSc1ccccc1)[Br])O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3371 |
| logD: | 4.8738 |
| logSw: | -5.6877 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.798 |
| InChI Key: | QGBWGFZKHSJGAS-UHFFFAOYSA-N |