ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-{[(thiophen-2-yl)sulfanyl]methyl}-1H-indole-3-carboxylate
Chemical Structure Depiction of
ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-{[(thiophen-2-yl)sulfanyl]methyl}-1H-indole-3-carboxylate
ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-{[(thiophen-2-yl)sulfanyl]methyl}-1H-indole-3-carboxylate
Compound characteristics
| Compound ID: | 4546-0073 |
| Compound Name: | ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-{[(thiophen-2-yl)sulfanyl]methyl}-1H-indole-3-carboxylate |
| Molecular Weight: | 519.91 |
| Molecular Formula: | C20 H23 Br N2 O3 S2 |
| Salt: | HCl |
| Smiles: | CCOC(c1c2c(CN(C)C)c(c(cc2n(C)c1CSc1cccs1)[Br])O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4031 |
| logD: | 2.9398 |
| logSw: | -4.5686 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.898 |
| InChI Key: | NZDNHRDPEYHJMS-UHFFFAOYSA-N |