rel-(4aR,8aS)-6-(cyclobutanecarbonyl)-1-(2-methoxyethyl)-4a-(pyrrolidine-1-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one
Chemical Structure Depiction of
rel-(4aR,8aS)-6-(cyclobutanecarbonyl)-1-(2-methoxyethyl)-4a-(pyrrolidine-1-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one
rel-(4aR,8aS)-6-(cyclobutanecarbonyl)-1-(2-methoxyethyl)-4a-(pyrrolidine-1-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one
Compound characteristics
| Compound ID: | SB17-0902 |
| Compound Name: | rel-(4aR,8aS)-6-(cyclobutanecarbonyl)-1-(2-methoxyethyl)-4a-(pyrrolidine-1-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one |
| Molecular Weight: | 391.51 |
| Molecular Formula: | C21 H33 N3 O4 |
| Smiles: | [H][C@@]12CCN(C[C@]1(CCC(N2CCOC)=O)C(N1CCCC1)=O)C(C1CCC1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.6033 |
| logD: | 0.6033 |
| logSw: | -0.3154 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.684 |
| InChI Key: | QPFOMJOBUVXKCW-UTKZUKDTSA-N |