4-[(1R,3aS,10aR,10bS)-2-benzoyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N,N-diethylbutanamide
Chemical Structure Depiction of
4-[(1R,3aS,10aR,10bS)-2-benzoyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N,N-diethylbutanamide
4-[(1R,3aS,10aR,10bS)-2-benzoyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N,N-diethylbutanamide
Compound characteristics
| Compound ID: | N121-0958 |
| Compound Name: | 4-[(1R,3aS,10aR,10bS)-2-benzoyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N,N-diethylbutanamide |
| Molecular Weight: | 425.61 |
| Molecular Formula: | C26 H39 N3 O2 |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(N(CC)CC)=O)N(C1)C(c1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.6362 |
| logD: | 0.1745 |
| logSw: | -2.7015 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.597 |
| InChI Key: | XJWZCXVFCKHYOH-KBOSCXGNSA-N |