5-(4,6-dibromo-7-methoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-N'-[(E)-(thiophen-3-yl)methylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide
Chemical Structure Depiction of
5-(4,6-dibromo-7-methoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-N'-[(E)-(thiophen-3-yl)methylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide
5-(4,6-dibromo-7-methoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-N'-[(E)-(thiophen-3-yl)methylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide
Compound characteristics
| Compound ID: | 8019-6209 |
| Compound Name: | 5-(4,6-dibromo-7-methoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-N'-[(E)-(thiophen-3-yl)methylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide |
| Molecular Weight: | 545.2 |
| Molecular Formula: | C18 H15 Br2 N3 O5 S |
| Smiles: | CC1C(c2c(c(c3c(c2[Br])OCO3)OC)[Br])ON=C1C(N/N=C/c1ccsc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7767 |
| logD: | 4.7543 |
| logSw: | -4.5025 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.18 |
| InChI Key: | FBSXKBSCYBAPCX-UHFFFAOYSA-N |