methyl 5-[(2-hydroxy-3-methylphenyl)methylidene]-2-(4-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 5-[(2-hydroxy-3-methylphenyl)methylidene]-2-(4-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
methyl 5-[(2-hydroxy-3-methylphenyl)methylidene]-2-(4-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V006-6682 |
| Compound Name: | methyl 5-[(2-hydroxy-3-methylphenyl)methylidene]-2-(4-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 381.45 |
| Molecular Formula: | C21 H19 N O4 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)NC1=C(C(/C(=C\c2cccc(C)c2O)S1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.2157 |
| logD: | 5.2005 |
| logSw: | -4.9765 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.016 |
| InChI Key: | SJSYVUHZEUJVMV-UHFFFAOYSA-N |