ethyl 5-(acetyloxy)-6-bromo-2-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1-methyl-1H-indole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(acetyloxy)-6-bromo-2-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1-methyl-1H-indole-3-carboxylate
ethyl 5-(acetyloxy)-6-bromo-2-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1-methyl-1H-indole-3-carboxylate
Compound characteristics
| Compound ID: | 8009-6173 |
| Compound Name: | ethyl 5-(acetyloxy)-6-bromo-2-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1-methyl-1H-indole-3-carboxylate |
| Molecular Weight: | 482.37 |
| Molecular Formula: | C21 H28 Br N3 O5 |
| Smiles: | CCOC(c1c2cc(c(cc2n(C)c1CN1CCN(CC1)CCO)[Br])OC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6969 |
| logD: | 0.7239 |
| logSw: | -1.8498 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.801 |
| InChI Key: | UYNUSFRRBOJRBS-UHFFFAOYSA-N |