methyl 5-[(4-hydroxy-2-methoxyphenyl)methylidene]-2-(2-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 5-[(4-hydroxy-2-methoxyphenyl)methylidene]-2-(2-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
methyl 5-[(4-hydroxy-2-methoxyphenyl)methylidene]-2-(2-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V018-5853 |
| Compound Name: | methyl 5-[(4-hydroxy-2-methoxyphenyl)methylidene]-2-(2-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 413.45 |
| Molecular Formula: | C21 H19 N O6 S |
| Salt: | not_available |
| Smiles: | COC(C1=C(Nc2ccccc2OC)SC(=C\c2ccc(cc2OC)O)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0744 |
| logD: | 3.8305 |
| logSw: | -4.2361 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.717 |
| InChI Key: | WVCXJHYDYDEUEJ-UHFFFAOYSA-N |