rel-(1R,5R)-N-(naphthalen-2-yl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Chemical Structure Depiction of
rel-(1R,5R)-N-(naphthalen-2-yl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
rel-(1R,5R)-N-(naphthalen-2-yl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Compound characteristics
| Compound ID: | K062-0072 |
| Compound Name: | rel-(1R,5R)-N-(naphthalen-2-yl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide |
| Molecular Weight: | 359.43 |
| Molecular Formula: | C22 H21 N3 O2 |
| Smiles: | C1[C@@H]2CN(C[C@H]1C1=CC=CC(N1C2)=O)C(Nc1ccc2ccccc2c1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.981 |
| logD: | 3.981 |
| logSw: | -4.1668 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.135 |
| InChI Key: | XQIYPVCXWHQGSV-YJBOKZPZSA-N |