4-[(1R,3aS,10aS,10bS)-2-(5-fluoro-2-methoxybenzene-1-sulfonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-1-(morpholin-4-yl)butan-1-one
Chemical Structure Depiction of
4-[(1R,3aS,10aS,10bS)-2-(5-fluoro-2-methoxybenzene-1-sulfonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-1-(morpholin-4-yl)butan-1-one
4-[(1R,3aS,10aS,10bS)-2-(5-fluoro-2-methoxybenzene-1-sulfonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-1-(morpholin-4-yl)butan-1-one
Compound characteristics
| Compound ID: | N106-0406 |
| Compound Name: | 4-[(1R,3aS,10aS,10bS)-2-(5-fluoro-2-methoxybenzene-1-sulfonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-1-(morpholin-4-yl)butan-1-one |
| Molecular Weight: | 523.67 |
| Molecular Formula: | C26 H38 F N3 O5 S |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(N2CCOCC2)=O)N(C1)S(c1cc(ccc1OC)F)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.5795 |
| logD: | 0.2533 |
| logSw: | -2.3846 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 66.692 |
| InChI Key: | WETKJKYTMUNELT-RKCWLVDCSA-N |