2-bromo-4-[rel-(4aR,10bR)-9-methyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol
Chemical Structure Depiction of
2-bromo-4-[rel-(4aR,10bR)-9-methyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol
2-bromo-4-[rel-(4aR,10bR)-9-methyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol
Compound characteristics
| Compound ID: | J038-0507 |
| Compound Name: | 2-bromo-4-[rel-(4aR,10bR)-9-methyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol |
| Molecular Weight: | 374.28 |
| Molecular Formula: | C19 H20 Br N O2 |
| Smiles: | Cc1ccc2c(c1)[C@@H]1[C@@H](CCCO1)C(c1ccc(c(c1)[Br])O)N2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2507 |
| logD: | 4.2123 |
| logSw: | -3.8982 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 37.378 |
| InChI Key: | RBUQBMYKAQGBLR-LPHKOSDUSA-N |