ethyl 5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-(2-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-(2-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-(2-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V017-9938 |
| Compound Name: | ethyl 5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-(2-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 425.5 |
| Molecular Formula: | C23 H23 N O5 S |
| Salt: | not_available |
| Smiles: | CCOC(C1=C(Nc2ccccc2C)SC(=C\c2ccc(c(c2)OCC)O)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7372 |
| logD: | 4.7174 |
| logSw: | -4.1611 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.178 |
| InChI Key: | RFYRNQPZXGFUMM-UHFFFAOYSA-N |