rel-(3aR,4S,9bS)-9-chloro-6-methoxy-4-(4-methoxy-3-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Chemical Structure Depiction of
rel-(3aR,4S,9bS)-9-chloro-6-methoxy-4-(4-methoxy-3-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
rel-(3aR,4S,9bS)-9-chloro-6-methoxy-4-(4-methoxy-3-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Compound characteristics
| Compound ID: | 5408-0907 |
| Compound Name: | rel-(3aR,4S,9bS)-9-chloro-6-methoxy-4-(4-methoxy-3-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline |
| Molecular Weight: | 386.83 |
| Molecular Formula: | C20 H19 Cl N2 O4 |
| Smiles: | [H][C@@]12CC=C[C@@]2([H])c2c(ccc(c2N[C@H]1c1ccc(c(c1)[N+]([O-])=O)OC)OC)[Cl] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.0259 |
| logD: | 4.0259 |
| logSw: | -4.6515 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.411 |
| InChI Key: | LOMHKTSXDZGTJT-JMERFSKESA-N |