(1R,3aS,10aR,10bS)-1-{4-[(cyclopropylmethyl)amino]-4-oxobutyl}-N-(propan-2-yl)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-(propan-2-yl)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-(propan-2-yl)octahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridine-2(3H)-carboxamide
Compound characteristics
| Compound ID: | N106-0730 |
| Compound Name: | (1R,3aS,10aR,10bS)-1-{4-[(cyclopropylmethyl)amino]-4-oxobutyl}-N-(propan-2-yl)octahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridine-2(3H)-carboxamide |
| Molecular Weight: | 404.6 |
| Molecular Formula: | C23 H40 N4 O2 |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(NCC2CC2)=O)N(C1)C(NC(C)C)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.8074 |
| logD: | -0.3953 |
| logSw: | -2.2931 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.305 |
| InChI Key: | GURRVWBAQRQMMY-NXLVEIQXSA-N |