2-ethyl-1-[(1R,3aS,10aR,10bS)-1-[4-(morpholin-4-yl)-4-oxobutyl]octahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-2(3H)-yl]butan-1-one
Chemical Structure Depiction of
2-ethyl-1-[(1R,3aS,10aR,10bS)-1-[4-(morpholin-4-yl)-4-oxobutyl]octahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-2(3H)-yl]butan-1-one
2-ethyl-1-[(1R,3aS,10aR,10bS)-1-[4-(morpholin-4-yl)-4-oxobutyl]octahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-2(3H)-yl]butan-1-one
Compound characteristics
| Compound ID: | N106-0334 |
| Compound Name: | 2-ethyl-1-[(1R,3aS,10aR,10bS)-1-[4-(morpholin-4-yl)-4-oxobutyl]octahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-2(3H)-yl]butan-1-one |
| Molecular Weight: | 433.63 |
| Molecular Formula: | C25 H43 N3 O3 |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(N2CCOCC2)=O)N(C1)C(C(CC)CC)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.0296 |
| logD: | -0.548 |
| logSw: | -2.0024 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.494 |
| InChI Key: | WZRCUWUXXJYGSG-GBEXAXCTSA-N |