(1R,3aS,10aR,10bS)-1-{4-[(cyclopropylmethyl)amino]-4-oxobutyl}-N-(3-methylbutyl)octahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridine-2(3H)-carboxamide
Chemical Structure Depiction of
(1R,3aS,10aR,10bS)-1-{4-[(cyclopropylmethyl)amino]-4-oxobutyl}-N-(3-methylbutyl)octahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridine-2(3H)-carboxamide
(1R,3aS,10aR,10bS)-1-{4-[(cyclopropylmethyl)amino]-4-oxobutyl}-N-(3-methylbutyl)octahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridine-2(3H)-carboxamide
Compound characteristics
| Compound ID: | N106-0838 |
| Compound Name: | (1R,3aS,10aR,10bS)-1-{4-[(cyclopropylmethyl)amino]-4-oxobutyl}-N-(3-methylbutyl)octahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridine-2(3H)-carboxamide |
| Molecular Weight: | 432.65 |
| Molecular Formula: | C25 H44 N4 O2 |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(NCC2CC2)=O)N(C1)C(NCCC(C)C)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.8264 |
| logD: | 0.6237 |
| logSw: | -3.1326 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.172 |
| InChI Key: | CWFUXFRJMIJDSF-GBEXAXCTSA-N |