ethyl rel-(3aR,4S,9bS)-4-[4-(methoxycarbonyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate
Chemical Structure Depiction of
ethyl rel-(3aR,4S,9bS)-4-[4-(methoxycarbonyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate
ethyl rel-(3aR,4S,9bS)-4-[4-(methoxycarbonyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate
Compound characteristics
| Compound ID: | 5408-0775 |
| Compound Name: | ethyl rel-(3aR,4S,9bS)-4-[4-(methoxycarbonyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate |
| Molecular Weight: | 377.44 |
| Molecular Formula: | C23 H23 N O4 |
| Smiles: | [H][C@@]12CC=C[C@@]2([H])c2cc(ccc2N[C@H]1c1ccc(cc1)C(=O)OC)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 5.5665 |
| logD: | 5.5665 |
| logSw: | -5.4624 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.249 |
| InChI Key: | MBTPSYGHODMTSU-WFXMLNOXSA-N |