rel-(3aR,9bR)-4-(3-iodo-4,5-dimethoxyphenyl)-8-methyl-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline
Chemical Structure Depiction of
rel-(3aR,9bR)-4-(3-iodo-4,5-dimethoxyphenyl)-8-methyl-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline
rel-(3aR,9bR)-4-(3-iodo-4,5-dimethoxyphenyl)-8-methyl-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline
Compound characteristics
| Compound ID: | J038-2789 |
| Compound Name: | rel-(3aR,9bR)-4-(3-iodo-4,5-dimethoxyphenyl)-8-methyl-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline |
| Molecular Weight: | 451.3 |
| Molecular Formula: | C20 H22 I N O3 |
| Smiles: | Cc1ccc2c(c1)[C@@H]1[C@@H](CCO1)C(c1cc(c(c(c1)I)OC)OC)N2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7029 |
| logD: | 4.7028 |
| logSw: | -4.4163 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.543 |
| InChI Key: | AURRAKPDAPEYME-LPHKOSDUSA-N |