ethyl 5-{[4-(diethylamino)-2-ethoxyphenyl]methylidene}-2-(4-ethylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-{[4-(diethylamino)-2-ethoxyphenyl]methylidene}-2-(4-ethylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 5-{[4-(diethylamino)-2-ethoxyphenyl]methylidene}-2-(4-ethylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4767-1268 |
| Compound Name: | ethyl 5-{[4-(diethylamino)-2-ethoxyphenyl]methylidene}-2-(4-ethylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 494.65 |
| Molecular Formula: | C28 H34 N2 O4 S |
| Smiles: | CCc1ccc(cc1)NC1=C(C(/C(=C/c2ccc(cc2OCC)N(CC)CC)S1)=O)C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 7.3201 |
| logD: | 7.3033 |
| logSw: | -5.5855 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.064 |
| InChI Key: | LKDAHCFKQSTCBM-UHFFFAOYSA-N |