rel-(4aR,8aS)-6-(3-fluoropyridine-4-carbonyl)-4a-(pyrrolidine-1-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one
Chemical Structure Depiction of
rel-(4aR,8aS)-6-(3-fluoropyridine-4-carbonyl)-4a-(pyrrolidine-1-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one
rel-(4aR,8aS)-6-(3-fluoropyridine-4-carbonyl)-4a-(pyrrolidine-1-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one
Compound characteristics
| Compound ID: | SB17-0170 |
| Compound Name: | rel-(4aR,8aS)-6-(3-fluoropyridine-4-carbonyl)-4a-(pyrrolidine-1-carbonyl)octahydro-1,6-naphthyridin-2(1H)-one |
| Molecular Weight: | 374.41 |
| Molecular Formula: | C19 H23 F N4 O3 |
| Smiles: | [H][C@@]12CCN(C[C@]1(CCC(N2)=O)C(N1CCCC1)=O)C(c1ccncc1F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.1882 |
| logD: | 0.1882 |
| logSw: | -1.5934 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.783 |
| InChI Key: | PEHDLUARHTTXKZ-KXBFYZLASA-N |