rel-(3aR,9bR)-4-(3-bromo-4,5-dimethoxyphenyl)-8-fluoro-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline
Chemical Structure Depiction of
rel-(3aR,9bR)-4-(3-bromo-4,5-dimethoxyphenyl)-8-fluoro-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline
rel-(3aR,9bR)-4-(3-bromo-4,5-dimethoxyphenyl)-8-fluoro-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline
Compound characteristics
| Compound ID: | J038-2413 |
| Compound Name: | rel-(3aR,9bR)-4-(3-bromo-4,5-dimethoxyphenyl)-8-fluoro-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline |
| Molecular Weight: | 408.27 |
| Molecular Formula: | C19 H19 Br F N O3 |
| Smiles: | COc1cc(cc(c1OC)[Br])C1[C@@H]2CCO[C@@H]2c2cc(ccc2N1)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1733 |
| logD: | 4.1733 |
| logSw: | -4.3206 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.543 |
| InChI Key: | PUJBYNLAWZKXCW-FQCAKNBISA-N |