2-[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]-N-{[(1RS)-octahydro-2H-quinolizin-1-yl]methyl}acetamide
Chemical Structure Depiction of
2-[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]-N-{[(1RS)-octahydro-2H-quinolizin-1-yl]methyl}acetamide
2-[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]-N-{[(1RS)-octahydro-2H-quinolizin-1-yl]methyl}acetamide
Compound characteristics
| Compound ID: | Y041-1675 |
| Compound Name: | 2-[(4-butyl-2-oxo-2H-1-benzopyran-7-yl)oxy]-N-{[(1RS)-octahydro-2H-quinolizin-1-yl]methyl}acetamide |
| Molecular Weight: | 426.56 |
| Molecular Formula: | C25 H34 N2 O4 |
| Smiles: | CCCCC1=CC(=O)Oc2cc(ccc12)OCC(NC[C@@H]1CCCN2CCCCC12)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.878 |
| logD: | 0.3824 |
| logSw: | -3.5103 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.695 |
| InChI Key: | VURQDAYVZPVYMN-LCQOSCCDSA-N |