1-(azepan-1-yl)-4-[(1R,3aS,10aR,10bS)-2-methyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]butan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-4-[(1R,3aS,10aR,10bS)-2-methyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]butan-1-one
1-(azepan-1-yl)-4-[(1R,3aS,10aR,10bS)-2-methyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]butan-1-one
Compound characteristics
| Compound ID: | N121-0037 |
| Compound Name: | 1-(azepan-1-yl)-4-[(1R,3aS,10aR,10bS)-2-methyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]butan-1-one |
| Molecular Weight: | 361.57 |
| Molecular Formula: | C22 H39 N3 O |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(N2CCCCCC2)=O)N(C)C1 |
| Stereo: | ABSOLUTE |
| logP: | 2.011 |
| logD: | 0.6535 |
| logSw: | -2.0235 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 22.8813 |
| InChI Key: | RHHYLKDMYMTDHF-NXLVEIQXSA-N |