2-(5-bromo-1H-indol-1-yl)-1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)ethan-1-one
Chemical Structure Depiction of
2-(5-bromo-1H-indol-1-yl)-1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)ethan-1-one
2-(5-bromo-1H-indol-1-yl)-1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)ethan-1-one
Compound characteristics
| Compound ID: | Y041-5142 |
| Compound Name: | 2-(5-bromo-1H-indol-1-yl)-1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)ethan-1-one |
| Molecular Weight: | 391.31 |
| Molecular Formula: | C19 H23 Br N2 O2 |
| Smiles: | C1CCC2(CCN(CC2C1)C(Cn1ccc2cc(ccc12)[Br])=O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4416 |
| logD: | 3.4416 |
| logSw: | -3.2794 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.342 |
| InChI Key: | DPTPQBWAUBHMMH-UHFFFAOYSA-N |