ethyl 6-bromo-5-hydroxy-1-methyl-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate
Chemical Structure Depiction of
ethyl 6-bromo-5-hydroxy-1-methyl-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate
ethyl 6-bromo-5-hydroxy-1-methyl-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate
Compound characteristics
| Compound ID: | 8009-2271 |
| Compound Name: | ethyl 6-bromo-5-hydroxy-1-methyl-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate |
| Molecular Weight: | 420.32 |
| Molecular Formula: | C19 H18 Br N O3 S |
| Smiles: | CCOC(c1c2cc(c(cc2n(C)c1CSc1ccccc1)[Br])O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6924 |
| logD: | 4.6637 |
| logSw: | -4.2536 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.061 |
| InChI Key: | DAFNNZWQTJQQAP-UHFFFAOYSA-N |