ethyl 5-[(furan-2-yl)methylidene]-2-(4-nitroanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(furan-2-yl)methylidene]-2-(4-nitroanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 5-[(furan-2-yl)methylidene]-2-(4-nitroanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3533-0029 |
| Compound Name: | ethyl 5-[(furan-2-yl)methylidene]-2-(4-nitroanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 386.38 |
| Molecular Formula: | C18 H14 N2 O6 S |
| Smiles: | CCOC(C1=C(Nc2ccc(cc2)[N+]([O-])=O)SC(=C/c2ccco2)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1686 |
| logD: | 2.7653 |
| logSw: | -4.0692 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.247 |
| InChI Key: | WUFFBCYVAJCQJK-UHFFFAOYSA-N |