5-[(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-N'-[(4-methoxyphenyl)methylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide
Chemical Structure Depiction of
5-[(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-N'-[(4-methoxyphenyl)methylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide
5-[(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-N'-[(4-methoxyphenyl)methylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide
Compound characteristics
| Compound ID: | 8019-7259 |
| Compound Name: | 5-[(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-N'-[(4-methoxyphenyl)methylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide |
| Molecular Weight: | 520.34 |
| Molecular Formula: | C22 H22 Br N3 O7 |
| Smiles: | COc1ccc(\C=N/NC(C2CC(Cc3c(c4c(c(c3[Br])OC)OCO4)OC)ON=2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0691 |
| logD: | 4.0308 |
| logSw: | -4.3454 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.852 |
| InChI Key: | YOJBKNJXKVIMJY-AWEZNQCLSA-N |