rel-(4aR,10bR)-5-(4-ethoxy-3-methoxyphenyl)-7,9-dimethyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline
Chemical Structure Depiction of
rel-(4aR,10bR)-5-(4-ethoxy-3-methoxyphenyl)-7,9-dimethyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline
rel-(4aR,10bR)-5-(4-ethoxy-3-methoxyphenyl)-7,9-dimethyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline
Compound characteristics
| Compound ID: | J038-1954 |
| Compound Name: | rel-(4aR,10bR)-5-(4-ethoxy-3-methoxyphenyl)-7,9-dimethyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline |
| Molecular Weight: | 367.49 |
| Molecular Formula: | C23 H29 N O3 |
| Smiles: | CCOc1ccc(cc1OC)C1[C@@H]2CCCO[C@@H]2c2cc(C)cc(C)c2N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0756 |
| logD: | 4.0746 |
| logSw: | -4.1545 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.419 |
| InChI Key: | NYZXVOAVEBYDSY-XHLMSTEBSA-N |