ethyl 2-(4-fluoroanilino)-4-oxo-5-[(pyridin-2-yl)methylidene]-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-fluoroanilino)-4-oxo-5-[(pyridin-2-yl)methylidene]-4,5-dihydrothiophene-3-carboxylate
ethyl 2-(4-fluoroanilino)-4-oxo-5-[(pyridin-2-yl)methylidene]-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
Compound ID: | V020-7600 |
Compound Name: | ethyl 2-(4-fluoroanilino)-4-oxo-5-[(pyridin-2-yl)methylidene]-4,5-dihydrothiophene-3-carboxylate |
Molecular Weight: | 370.4 |
Molecular Formula: | C19 H15 F N2 O3 S |
Salt: | not_available |
Smiles: | CCOC(C1=C(Nc2ccc(cc2)F)SC(=C\c2ccccn2)\C1=O)=O |
Stereo: | ACHIRAL |
logP: | 3.8317 |
logD: | 3.3448 |
logSw: | -3.9054 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.66 |
InChI Key: | VUSGJGBPZUWAPX-UHFFFAOYSA-N |