3-[(2-fluoro-5-nitroanilino)methylidene]-1,5-dioxaspiro[5.5]undecane-2,4-dione
Chemical Structure Depiction of
3-[(2-fluoro-5-nitroanilino)methylidene]-1,5-dioxaspiro[5.5]undecane-2,4-dione
3-[(2-fluoro-5-nitroanilino)methylidene]-1,5-dioxaspiro[5.5]undecane-2,4-dione
Compound characteristics
| Compound ID: | K699-0078 |
| Compound Name: | 3-[(2-fluoro-5-nitroanilino)methylidene]-1,5-dioxaspiro[5.5]undecane-2,4-dione |
| Molecular Weight: | 350.3 |
| Molecular Formula: | C16 H15 F N2 O6 |
| Smiles: | C1CCC2(CC1)OC(C(=CNc1cc(ccc1F)[N+]([O-])=O)C(=O)O2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7421 |
| logD: | -0.6684 |
| logSw: | -3.3328 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.614 |
| InChI Key: | GZPLTYRDINPSDB-UHFFFAOYSA-N |