methyl 5-[(2-hydroxyphenyl)methylidene]-2-(4-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 5-[(2-hydroxyphenyl)methylidene]-2-(4-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
methyl 5-[(2-hydroxyphenyl)methylidene]-2-(4-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V009-2821 |
| Compound Name: | methyl 5-[(2-hydroxyphenyl)methylidene]-2-(4-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 383.42 |
| Molecular Formula: | C20 H17 N O5 S |
| Salt: | not_available |
| Smiles: | COC(C1=C(Nc2ccc(cc2)OC)SC(=C\c2ccccc2O)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2238 |
| logD: | 4.1815 |
| logSw: | -3.8502 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.629 |
| InChI Key: | AGFJYLBGCWCKKA-UHFFFAOYSA-N |