N'-[(E)-{4-ethoxy-3-[(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)methyl]phenyl}methylidene]-2-(4-methoxyphenoxy)acetohydrazide
Chemical Structure Depiction of
N'-[(E)-{4-ethoxy-3-[(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)methyl]phenyl}methylidene]-2-(4-methoxyphenoxy)acetohydrazide
N'-[(E)-{4-ethoxy-3-[(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)methyl]phenyl}methylidene]-2-(4-methoxyphenoxy)acetohydrazide
Compound characteristics
| Compound ID: | K089-0165 |
| Compound Name: | N'-[(E)-{4-ethoxy-3-[(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)methyl]phenyl}methylidene]-2-(4-methoxyphenoxy)acetohydrazide |
| Molecular Weight: | 530.62 |
| Molecular Formula: | C30 H34 N4 O5 |
| Smiles: | CCOc1ccc(/C=N/NC(COc2ccc(cc2)OC)=O)cc1CN1CC2CC(C1)C1=CC=CC(N1C2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0898 |
| logD: | 3.6789 |
| logSw: | -4.2699 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.025 |
| InChI Key: | UJILCRAQARTGLR-UHFFFAOYSA-N |