rel-(4aR,8aS)-6-(1-phenylcyclopentane-1-carbonyl)-4a-(pyrrolidine-1-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one
Chemical Structure Depiction of
rel-(4aR,8aS)-6-(1-phenylcyclopentane-1-carbonyl)-4a-(pyrrolidine-1-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one
rel-(4aR,8aS)-6-(1-phenylcyclopentane-1-carbonyl)-4a-(pyrrolidine-1-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one
Compound characteristics
| Compound ID: | SB17-0165 |
| Compound Name: | rel-(4aR,8aS)-6-(1-phenylcyclopentane-1-carbonyl)-4a-(pyrrolidine-1-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one |
| Molecular Weight: | 423.56 |
| Molecular Formula: | C25 H33 N3 O3 |
| Smiles: | [H][C@@]12CCN(C[C@]1(CCC(N2)=O)C(N1CCCC1)=O)C(C1(CCCC1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.1812 |
| logD: | 2.1812 |
| logSw: | -2.4439 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.552 |
| InChI Key: | DEWWQMCHGAYIBY-NLFFAJNJSA-N |