ethyl 2-anilino-5-[(4-hydroxy-3-methylphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-anilino-5-[(4-hydroxy-3-methylphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 2-anilino-5-[(4-hydroxy-3-methylphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V022-2409 |
| Compound Name: | ethyl 2-anilino-5-[(4-hydroxy-3-methylphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 381.45 |
| Molecular Formula: | C21 H19 N O4 S |
| Salt: | not_available |
| Smiles: | CCOC(C1=C(Nc2ccccc2)SC(=C\c2ccc(c(C)c2)O)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5189 |
| logD: | 4.5073 |
| logSw: | -3.9702 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.665 |
| InChI Key: | PQYRUKVBKPTEOS-UHFFFAOYSA-N |