rel-(4aR,8aS)-1-(2-methoxyethyl)-6-[(3-methylphenoxy)acetyl]-2-oxo-N-(propan-2-yl)octahydro-1,6-naphthyridine-4a(2H)-carboxamide
Chemical Structure Depiction of
rel-(4aR,8aS)-1-(2-methoxyethyl)-6-[(3-methylphenoxy)acetyl]-2-oxo-N-(propan-2-yl)octahydro-1,6-naphthyridine-4a(2H)-carboxamide
rel-(4aR,8aS)-1-(2-methoxyethyl)-6-[(3-methylphenoxy)acetyl]-2-oxo-N-(propan-2-yl)octahydro-1,6-naphthyridine-4a(2H)-carboxamide
Compound characteristics
| Compound ID: | SB17-0761 |
| Compound Name: | rel-(4aR,8aS)-1-(2-methoxyethyl)-6-[(3-methylphenoxy)acetyl]-2-oxo-N-(propan-2-yl)octahydro-1,6-naphthyridine-4a(2H)-carboxamide |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C24 H35 N3 O5 |
| Smiles: | [H][C@@]12CCN(C[C@]1(CCC(N2CCOC)=O)C(NC(C)C)=O)C(COc1cccc(C)c1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.5178 |
| logD: | 1.5178 |
| logSw: | -2.2506 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.777 |
| InChI Key: | VLHYBFOMXZZMCA-YKSBVNFPSA-N |