ethyl rel-(3aR,4S,9bS)-4-(2-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylate
Chemical Structure Depiction of
ethyl rel-(3aR,4S,9bS)-4-(2-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylate
ethyl rel-(3aR,4S,9bS)-4-(2-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylate
Compound characteristics
| Compound ID: | 6177-0156 |
| Compound Name: | ethyl rel-(3aR,4S,9bS)-4-(2-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylate |
| Molecular Weight: | 364.4 |
| Molecular Formula: | C21 H20 N2 O4 |
| Smiles: | [H][C@@]12CC=C[C@@]2([H])c2cccc(C(=O)OCC)c2N[C@H]1c1ccccc1[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.6035 |
| logD: | 4.6035 |
| logSw: | -4.5062 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.904 |
| InChI Key: | IUCIOCQDDTVZBC-LPMFXHHGSA-N |