ethyl 2-(3,4-dimethoxyanilino)-5-[(2-hydroxy-4,6-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(3,4-dimethoxyanilino)-5-[(2-hydroxy-4,6-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 2-(3,4-dimethoxyanilino)-5-[(2-hydroxy-4,6-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V015-7127 |
| Compound Name: | ethyl 2-(3,4-dimethoxyanilino)-5-[(2-hydroxy-4,6-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 487.53 |
| Molecular Formula: | C24 H25 N O8 S |
| Salt: | not_available |
| Smiles: | CCOC(C1=C(Nc2ccc(c(c2)OC)OC)SC(=C\c2c(cc(cc2OC)OC)O)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3085 |
| logD: | 4.1205 |
| logSw: | -4.0438 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.1 |
| InChI Key: | OHBGUSUWQZGGTQ-UHFFFAOYSA-N |