ethyl 5-[(5-bromothiophen-2-yl)methylidene]-2-(4-ethoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(5-bromothiophen-2-yl)methylidene]-2-(4-ethoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 5-[(5-bromothiophen-2-yl)methylidene]-2-(4-ethoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 5648-1283 |
| Compound Name: | ethyl 5-[(5-bromothiophen-2-yl)methylidene]-2-(4-ethoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 480.4 |
| Molecular Formula: | C20 H18 Br N O4 S2 |
| Smiles: | CCOC(C1=C(Nc2ccc(cc2)OCC)SC(=C/c2ccc(s2)[Br])\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9987 |
| logD: | 5.9734 |
| logSw: | -5.5374 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.259 |
| InChI Key: | NOWCJJRJUPWGDW-UHFFFAOYSA-N |