rel-(3aR,4S,9bS)-9-chloro-6-methyl-4-(pyridin-4-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Chemical Structure Depiction of
rel-(3aR,4S,9bS)-9-chloro-6-methyl-4-(pyridin-4-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
rel-(3aR,4S,9bS)-9-chloro-6-methyl-4-(pyridin-4-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Compound characteristics
| Compound ID: | 5408-1274 |
| Compound Name: | rel-(3aR,4S,9bS)-9-chloro-6-methyl-4-(pyridin-4-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline |
| Molecular Weight: | 296.8 |
| Molecular Formula: | C18 H17 Cl N2 |
| Smiles: | [H][C@@]12CC=C[C@@]2([H])c2c(ccc(C)c2N[C@H]1c1ccncc1)[Cl] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.8827 |
| logD: | 3.8773 |
| logSw: | -4.2175 |
| Hydrogen bond acceptors count: | 1 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 19.4976 |
| InChI Key: | IOTCVFOATHRDOF-PMUMKWKESA-N |