rel-(4aR,8aR)-N-[(2-chlorophenyl)methyl]-1-(2-methoxyethyl)-2-oxooctahydroquinoline-4a(2H)-carboxamide
Chemical Structure Depiction of
rel-(4aR,8aR)-N-[(2-chlorophenyl)methyl]-1-(2-methoxyethyl)-2-oxooctahydroquinoline-4a(2H)-carboxamide
rel-(4aR,8aR)-N-[(2-chlorophenyl)methyl]-1-(2-methoxyethyl)-2-oxooctahydroquinoline-4a(2H)-carboxamide
Compound characteristics
| Compound ID: | T854-0849 |
| Compound Name: | rel-(4aR,8aR)-N-[(2-chlorophenyl)methyl]-1-(2-methoxyethyl)-2-oxooctahydroquinoline-4a(2H)-carboxamide |
| Molecular Weight: | 378.9 |
| Molecular Formula: | C20 H27 Cl N2 O3 |
| Smiles: | [H][C@@]12CCCC[C@]1(CCC(N2CCOC)=O)C(NCc1ccccc1[Cl])=O |
| Stereo: | RELATIVE |
| logP: | 2.8553 |
| logD: | 2.8553 |
| logSw: | -3.4198 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.17 |
| InChI Key: | ODKYNUGWRABOAX-PXNSSMCTSA-N |