rel-(3aR,9bR)-4-(5-bromo-2-methoxyphenyl)-8-ethyl-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline
Chemical Structure Depiction of
rel-(3aR,9bR)-4-(5-bromo-2-methoxyphenyl)-8-ethyl-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline
rel-(3aR,9bR)-4-(5-bromo-2-methoxyphenyl)-8-ethyl-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline
Compound characteristics
| Compound ID: | J038-2849 |
| Compound Name: | rel-(3aR,9bR)-4-(5-bromo-2-methoxyphenyl)-8-ethyl-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline |
| Molecular Weight: | 388.3 |
| Molecular Formula: | C20 H22 Br N O2 |
| Smiles: | CCc1ccc2c(c1)[C@@H]1[C@@H](CCO1)C(c1cc(ccc1OC)[Br])N2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3969 |
| logD: | 5.3969 |
| logSw: | -5.4939 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.8264 |
| InChI Key: | GJWLSGOCSJAGKJ-XLDGYAMZSA-N |