N'-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-cyanoacetohydrazide
Chemical Structure Depiction of
N'-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-cyanoacetohydrazide
N'-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-cyanoacetohydrazide
Compound characteristics
| Compound ID: | 8003-5922 |
| Compound Name: | N'-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-2-cyanoacetohydrazide |
| Molecular Weight: | 310.1 |
| Molecular Formula: | C11 H8 Br N3 O3 |
| Smiles: | C(C#N)C(N/N=C/c1cc2c(cc1[Br])OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6547 |
| logD: | 1.6318 |
| logSw: | -2.1706 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.22 |
| InChI Key: | MQQQQPCZSJLJDT-UHFFFAOYSA-N |