4-[(1R,3aS,10aR,10bS)-2-acetyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-[3-(4-ethylpiperazin-1-yl)propyl]butanamide
Chemical Structure Depiction of
4-[(1R,3aS,10aR,10bS)-2-acetyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-[3-(4-ethylpiperazin-1-yl)propyl]butanamide
4-[(1R,3aS,10aR,10bS)-2-acetyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-[3-(4-ethylpiperazin-1-yl)propyl]butanamide
Compound characteristics
| Compound ID: | N121-0855 |
| Compound Name: | 4-[(1R,3aS,10aR,10bS)-2-acetyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-[3-(4-ethylpiperazin-1-yl)propyl]butanamide |
| Molecular Weight: | 461.69 |
| Molecular Formula: | C26 H47 N5 O2 |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(NCCCN2CCN(CC)CC2)=O)N(C1)C(C)=O |
| Stereo: | ABSOLUTE |
| logP: | -0.158 |
| logD: | -2.7356 |
| logSw: | -0.9013 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.493 |
| InChI Key: | UVTCIHWVHKRGGL-PMHJDTQVSA-N |