ethyl 1-benzyl-2-[(4-benzylpiperazin-1-yl)methyl]-6-bromo-5-hydroxy-1H-indole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-benzyl-2-[(4-benzylpiperazin-1-yl)methyl]-6-bromo-5-hydroxy-1H-indole-3-carboxylate
ethyl 1-benzyl-2-[(4-benzylpiperazin-1-yl)methyl]-6-bromo-5-hydroxy-1H-indole-3-carboxylate
Compound characteristics
| Compound ID: | 8014-8125 |
| Compound Name: | ethyl 1-benzyl-2-[(4-benzylpiperazin-1-yl)methyl]-6-bromo-5-hydroxy-1H-indole-3-carboxylate |
| Molecular Weight: | 562.51 |
| Molecular Formula: | C30 H32 Br N3 O3 |
| Smiles: | CCOC(c1c2cc(c(cc2n(Cc2ccccc2)c1CN1CCN(CC1)Cc1ccccc1)[Br])O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4188 |
| logD: | 4.9295 |
| logSw: | -5.3362 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.524 |
| InChI Key: | ROCSMWBNFKAGOT-UHFFFAOYSA-N |