rel-(3aR,9bR)-8-methyl-4-{3-[(prop-2-en-1-yl)oxy]phenyl}-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline
Chemical Structure Depiction of
rel-(3aR,9bR)-8-methyl-4-{3-[(prop-2-en-1-yl)oxy]phenyl}-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline
rel-(3aR,9bR)-8-methyl-4-{3-[(prop-2-en-1-yl)oxy]phenyl}-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline
Compound characteristics
| Compound ID: | J038-2806 |
| Compound Name: | rel-(3aR,9bR)-8-methyl-4-{3-[(prop-2-en-1-yl)oxy]phenyl}-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline |
| Molecular Weight: | 321.42 |
| Molecular Formula: | C21 H23 N O2 |
| Smiles: | Cc1ccc2c(c1)[C@@H]1[C@@H](CCO1)C(c1cccc(c1)OCC=C)N2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5131 |
| logD: | 4.5128 |
| logSw: | -4.4006 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.6137 |
| InChI Key: | ZXQUYPMEJORGDU-LYHOZKKVSA-N |