ethyl 2-(2-fluoroanilino)-4-oxo-5-[(pyridin-3-yl)methylidene]-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-fluoroanilino)-4-oxo-5-[(pyridin-3-yl)methylidene]-4,5-dihydrothiophene-3-carboxylate
ethyl 2-(2-fluoroanilino)-4-oxo-5-[(pyridin-3-yl)methylidene]-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V022-2395 |
| Compound Name: | ethyl 2-(2-fluoroanilino)-4-oxo-5-[(pyridin-3-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(Nc2ccccc2F)SC(=C\c2cccnc2)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8619 |
| logD: | 3.3748 |
| logSw: | -3.6341 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.937 |
| InChI Key: | FPWSJHPQHWQKSC-UHFFFAOYSA-N |