rel-(4aR,8aS)-6-(2-ethoxybenzoyl)-4a-(morpholine-4-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one
Chemical Structure Depiction of
rel-(4aR,8aS)-6-(2-ethoxybenzoyl)-4a-(morpholine-4-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one
rel-(4aR,8aS)-6-(2-ethoxybenzoyl)-4a-(morpholine-4-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one
Compound characteristics
| Compound ID: | SB17-0268 |
| Compound Name: | rel-(4aR,8aS)-6-(2-ethoxybenzoyl)-4a-(morpholine-4-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one |
| Molecular Weight: | 415.49 |
| Molecular Formula: | C22 H29 N3 O5 |
| Smiles: | [H][C@@]12CCN(C[C@]1(CCC(N2)=O)C(N1CCOCC1)=O)C(c1ccccc1OCC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.3834 |
| logD: | 0.3834 |
| logSw: | -2.3241 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.018 |
| InChI Key: | YMVFEFKPHVCWNE-GCJKJVERSA-N |