rel-(4aR,10bR)-9-methyl-5-(pyridin-3-yl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline
Chemical Structure Depiction of
rel-(4aR,10bR)-9-methyl-5-(pyridin-3-yl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline
rel-(4aR,10bR)-9-methyl-5-(pyridin-3-yl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline
Compound characteristics
| Compound ID: | J038-0558 |
| Compound Name: | rel-(4aR,10bR)-9-methyl-5-(pyridin-3-yl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline |
| Molecular Weight: | 280.37 |
| Molecular Formula: | C18 H20 N2 O |
| Smiles: | Cc1ccc2c(c1)[C@@H]1[C@@H](CCCO1)C(c1cccnc1)N2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9456 |
| logD: | 2.9455 |
| logSw: | -2.8502 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.3478 |
| InChI Key: | APJVYLXYTAOQHZ-HRWMIKOJSA-N |