2-[amino(4-amino-1,2,5-oxadiazol-3-yl)methylidene]-1-phenylbutane-1,3-dione
Chemical Structure Depiction of
2-[amino(4-amino-1,2,5-oxadiazol-3-yl)methylidene]-1-phenylbutane-1,3-dione
2-[amino(4-amino-1,2,5-oxadiazol-3-yl)methylidene]-1-phenylbutane-1,3-dione
Compound characteristics
| Compound ID: | 5434-0028 |
| Compound Name: | 2-[amino(4-amino-1,2,5-oxadiazol-3-yl)methylidene]-1-phenylbutane-1,3-dione |
| Molecular Weight: | 272.26 |
| Molecular Formula: | C13 H12 N4 O3 |
| Smiles: | CC(\C(=C(/c1c(N)non1)N)C(c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0829 |
| logD: | 1.0828 |
| logSw: | -1.7595 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 105.758 |
| InChI Key: | RWBITWFBKPYBFN-UHFFFAOYSA-N |