ethyl 2-(4-ethylanilino)-5-{[3-methoxy-4-(2-methoxy-2-oxoethoxy)phenyl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-ethylanilino)-5-{[3-methoxy-4-(2-methoxy-2-oxoethoxy)phenyl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 2-(4-ethylanilino)-5-{[3-methoxy-4-(2-methoxy-2-oxoethoxy)phenyl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 5648-1236 |
| Compound Name: | ethyl 2-(4-ethylanilino)-5-{[3-methoxy-4-(2-methoxy-2-oxoethoxy)phenyl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 497.57 |
| Molecular Formula: | C26 H27 N O7 S |
| Smiles: | CCc1ccc(cc1)NC1=C(C(/C(=C/c2ccc(c(c2)OC)OCC(=O)OC)S1)=O)C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.8876 |
| logD: | 4.8724 |
| logSw: | -4.6814 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.912 |
| InChI Key: | OVCDHSSZFBPERI-UHFFFAOYSA-N |