ethyl 2-(2-chloroanilino)-5-[(2-hydroxy-4,6-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-chloroanilino)-5-[(2-hydroxy-4,6-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 2-(2-chloroanilino)-5-[(2-hydroxy-4,6-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V011-5211 |
| Compound Name: | ethyl 2-(2-chloroanilino)-5-[(2-hydroxy-4,6-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 461.92 |
| Molecular Formula: | C22 H20 Cl N O6 S |
| Salt: | not_available |
| Smiles: | CCOC(C1=C(Nc2ccccc2[Cl])SC(=C\c2c(cc(cc2OC)OC)O)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0837 |
| logD: | 4.5966 |
| logSw: | -4.9701 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.142 |
| InChI Key: | CEQUDXGGJOKXSZ-WOJGMQOQSA-N |