5-bromo-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-hydroxybenzohydrazide
Chemical Structure Depiction of
5-bromo-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-hydroxybenzohydrazide
5-bromo-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-hydroxybenzohydrazide
Compound characteristics
| Compound ID: | K087-0514 |
| Compound Name: | 5-bromo-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-hydroxybenzohydrazide |
| Molecular Weight: | 565.47 |
| Molecular Formula: | C28 H29 Br N4 O4 |
| Smiles: | CCOc1ccc(/C=N/NC(c2cc(ccc2O)[Br])=O)cc1CN1CC2CC(C1)C1=CC=CC(N1C2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4314 |
| logD: | 5.0206 |
| logSw: | -5.1236 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.744 |
| InChI Key: | SIWCFDYYDVPEHU-UHFFFAOYSA-N |