(3aR*,4S*,9bS*)-8-[(3S*,5R*)-adamantan-1-yl]-4-(pyridin-3-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Chemical Structure Depiction of
(3aR*,4S*,9bS*)-8-[(3S*,5R*)-adamantan-1-yl]-4-(pyridin-3-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
(3aR*,4S*,9bS*)-8-[(3S*,5R*)-adamantan-1-yl]-4-(pyridin-3-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Compound characteristics
| Compound ID: | 8011-5603 |
| Compound Name: | (3aR*,4S*,9bS*)-8-[(3S*,5R*)-adamantan-1-yl]-4-(pyridin-3-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline |
| Molecular Weight: | 382.55 |
| Molecular Formula: | C27 H30 N2 |
| Smiles: | [H]C12C[C@@]3([H])C[C@@]([H])(C1)C[C@@](C2)(C3)c1ccc2c(c1)[C@]1([H])C=CC[C@]1([H])[C@H](c1cccnc1)N2 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 6.9435 |
| logD: | 6.9435 |
| logSw: | -6.1221 |
| Hydrogen bond acceptors count: | 1 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 21.6011 |
| InChI Key: | FXKOZSJVNPPUCN-FSTLSLPOSA-N |