ethyl 2-(4-chloroanilino)-4-oxo-5-[(2,4,5-trimethoxyphenyl)methylidene]-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-chloroanilino)-4-oxo-5-[(2,4,5-trimethoxyphenyl)methylidene]-4,5-dihydrothiophene-3-carboxylate
ethyl 2-(4-chloroanilino)-4-oxo-5-[(2,4,5-trimethoxyphenyl)methylidene]-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4302-2403 |
| Compound Name: | ethyl 2-(4-chloroanilino)-4-oxo-5-[(2,4,5-trimethoxyphenyl)methylidene]-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 475.95 |
| Molecular Formula: | C23 H22 Cl N O6 S |
| Smiles: | CCOC(C1=C(Nc2ccc(cc2)[Cl])SC(=C/c2cc(c(cc2OC)OC)OC)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0856 |
| logD: | 4.6559 |
| logSw: | -5.2871 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.008 |
| InChI Key: | GWMNAVUEONTCNA-UHFFFAOYSA-N |