(11aR)-8-oxo-N-[3-(trifluoromethyl)phenyl]octahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Chemical Structure Depiction of
(11aR)-8-oxo-N-[3-(trifluoromethyl)phenyl]octahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
(11aR)-8-oxo-N-[3-(trifluoromethyl)phenyl]octahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Compound characteristics
| Compound ID: | N107-0221 |
| Compound Name: | (11aR)-8-oxo-N-[3-(trifluoromethyl)phenyl]octahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide |
| Molecular Weight: | 381.4 |
| Molecular Formula: | C19 H22 F3 N3 O2 |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(C2)C(Nc1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.1359 |
| logD: | 3.1359 |
| logSw: | -3.4053 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.941 |
| InChI Key: | QRVMPEORPDMCAG-WOSRLPQWSA-N |