methyl 2-(4-fluoroanilino)-4-oxo-5-[(pyridin-2-yl)methylidene]-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-(4-fluoroanilino)-4-oxo-5-[(pyridin-2-yl)methylidene]-4,5-dihydrothiophene-3-carboxylate
methyl 2-(4-fluoroanilino)-4-oxo-5-[(pyridin-2-yl)methylidene]-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V020-7564 |
| Compound Name: | methyl 2-(4-fluoroanilino)-4-oxo-5-[(pyridin-2-yl)methylidene]-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 356.37 |
| Molecular Formula: | C18 H13 F N2 O3 S |
| Salt: | not_available |
| Smiles: | COC(C1=C(Nc2ccc(cc2)F)SC(=C\c2ccccn2)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2594 |
| logD: | 2.7725 |
| logSw: | -3.6901 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.08 |
| InChI Key: | BFSORHHHIBYPNB-UHFFFAOYSA-N |