ethyl 2-(3-fluoroanilino)-5-[(3-hydroxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(3-fluoroanilino)-5-[(3-hydroxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 2-(3-fluoroanilino)-5-[(3-hydroxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V018-4655 |
| Compound Name: | ethyl 2-(3-fluoroanilino)-5-[(3-hydroxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 385.41 |
| Molecular Formula: | C20 H16 F N O4 S |
| Salt: | not_available |
| Smiles: | CCOC(C1=C(Nc2cccc(c2)F)SC(=C\c2cccc(c2)O)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6347 |
| logD: | 4.1517 |
| logSw: | -4.1795 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.734 |
| InChI Key: | JHVAPOHCDNLFDJ-UHFFFAOYSA-N |