ethyl 2-anilino-5-[(5-chloro-2-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-anilino-5-[(5-chloro-2-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 2-anilino-5-[(5-chloro-2-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 5648-3072 |
| Compound Name: | ethyl 2-anilino-5-[(5-chloro-2-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 415.89 |
| Molecular Formula: | C21 H18 Cl N O4 S |
| Smiles: | CCOC(C1=C(Nc2ccccc2)SC(=C/c2cc(ccc2OC)[Cl])\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6352 |
| logD: | 5.6237 |
| logSw: | -5.8496 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.748 |
| InChI Key: | JOZRYJWSPXGXFV-UHFFFAOYSA-N |