rel-(4aR,8aR)-1-(2-methoxyethyl)-N-methyl-2-oxo-N-[2-(pyridin-2-yl)ethyl]octahydroquinoline-4a(2H)-carboxamide
Chemical Structure Depiction of
rel-(4aR,8aR)-1-(2-methoxyethyl)-N-methyl-2-oxo-N-[2-(pyridin-2-yl)ethyl]octahydroquinoline-4a(2H)-carboxamide
rel-(4aR,8aR)-1-(2-methoxyethyl)-N-methyl-2-oxo-N-[2-(pyridin-2-yl)ethyl]octahydroquinoline-4a(2H)-carboxamide
Compound characteristics
| Compound ID: | T854-0642 |
| Compound Name: | rel-(4aR,8aR)-1-(2-methoxyethyl)-N-methyl-2-oxo-N-[2-(pyridin-2-yl)ethyl]octahydroquinoline-4a(2H)-carboxamide |
| Molecular Weight: | 373.49 |
| Molecular Formula: | C21 H31 N3 O3 |
| Smiles: | [H][C@@]12CCCC[C@]1(CCC(N2CCOC)=O)C(N(C)CCc1ccccn1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3521 |
| logD: | 1.3453 |
| logSw: | -1.6239 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.429 |
| InChI Key: | QEAPPLBBOXZRJZ-RXVVDRJESA-N |