ethyl 5-({3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-(4-ethylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-({3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-(4-ethylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 5-({3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-(4-ethylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 5648-1238 |
| Compound Name: | ethyl 5-({3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-(4-ethylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 479.59 |
| Molecular Formula: | C27 H29 N O5 S |
| Smiles: | CCc1ccc(cc1)NC1=C(C(/C(=C/c2ccc(c(c2)OCC)OCC=C)S1)=O)C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 6.4414 |
| logD: | 6.4262 |
| logSw: | -5.7248 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.832 |
| InChI Key: | NWBACMGENDBFII-UHFFFAOYSA-N |