(1R,3aS,10aR,10bS)-1-(4-anilino-4-oxobutyl)-N-ethyloctahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridine-2(3H)-carboxamide
Chemical Structure Depiction of
(1R,3aS,10aR,10bS)-1-(4-anilino-4-oxobutyl)-N-ethyloctahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridine-2(3H)-carboxamide
(1R,3aS,10aR,10bS)-1-(4-anilino-4-oxobutyl)-N-ethyloctahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridine-2(3H)-carboxamide
Compound characteristics
| Compound ID: | N106-1001 |
| Compound Name: | (1R,3aS,10aR,10bS)-1-(4-anilino-4-oxobutyl)-N-ethyloctahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridine-2(3H)-carboxamide |
| Molecular Weight: | 412.58 |
| Molecular Formula: | C24 H36 N4 O2 |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(Nc2ccccc2)=O)N(C1)C(NCC)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.1885 |
| logD: | -0.0143 |
| logSw: | -2.6164 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.111 |
| InChI Key: | OINJETMGMFWXCU-KTDPBYDISA-N |