5-(4-bromo-6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-N'-[(E)-(3-fluorophenyl)methylidene]-4-methyl-4,5-dihydro-1,2-oxazole-3-carbohydrazide
Chemical Structure Depiction of
5-(4-bromo-6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-N'-[(E)-(3-fluorophenyl)methylidene]-4-methyl-4,5-dihydro-1,2-oxazole-3-carbohydrazide
5-(4-bromo-6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-N'-[(E)-(3-fluorophenyl)methylidene]-4-methyl-4,5-dihydro-1,2-oxazole-3-carbohydrazide
Compound characteristics
| Compound ID: | 8019-6203 |
| Compound Name: | 5-(4-bromo-6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-N'-[(E)-(3-fluorophenyl)methylidene]-4-methyl-4,5-dihydro-1,2-oxazole-3-carbohydrazide |
| Molecular Weight: | 508.3 |
| Molecular Formula: | C21 H19 Br F N3 O6 |
| Smiles: | CC1C(c2c(c(c3c(c2[Br])OCO3)OC)OC)ON=C1C(N/N=C/c1cccc(c1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3705 |
| logD: | 4.2075 |
| logSw: | -4.3616 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.879 |
| InChI Key: | XLXUQUYSHFXAIM-UHFFFAOYSA-N |