methyl 2-(2-chloroanilino)-5-[(2-hydroxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-(2-chloroanilino)-5-[(2-hydroxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
methyl 2-(2-chloroanilino)-5-[(2-hydroxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V009-2790 |
| Compound Name: | methyl 2-(2-chloroanilino)-5-[(2-hydroxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 387.84 |
| Molecular Formula: | C19 H14 Cl N O4 S |
| Salt: | not_available |
| Smiles: | COC(C1=C(Nc2ccccc2[Cl])SC(=C\c2ccccc2O)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5516 |
| logD: | 4.0644 |
| logSw: | -4.0674 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.388 |
| InChI Key: | IHSXZZGPAFUQRH-UHFFFAOYSA-N |