rel-(4aR,10bR)-9-ethyl-5-(pyridin-4-yl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline
Chemical Structure Depiction of
rel-(4aR,10bR)-9-ethyl-5-(pyridin-4-yl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline
rel-(4aR,10bR)-9-ethyl-5-(pyridin-4-yl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline
Compound characteristics
| Compound ID: | J038-0664 |
| Compound Name: | rel-(4aR,10bR)-9-ethyl-5-(pyridin-4-yl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline |
| Molecular Weight: | 294.39 |
| Molecular Formula: | C19 H22 N2 O |
| Smiles: | CCc1ccc2c(c1)[C@@H]1[C@@H](CCCO1)C(c1ccncc1)N2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5225 |
| logD: | 3.517 |
| logSw: | -3.502 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.2582 |
| InChI Key: | ZLMYAQXTQYXAFG-GZMMRYBBSA-N |