ethyl 2-(4-methylbenzamido)-4-oxo-5-{[4-(propan-2-yl)phenyl]methylidene}-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-methylbenzamido)-4-oxo-5-{[4-(propan-2-yl)phenyl]methylidene}-4,5-dihydrothiophene-3-carboxylate
ethyl 2-(4-methylbenzamido)-4-oxo-5-{[4-(propan-2-yl)phenyl]methylidene}-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 5648-3138 |
| Compound Name: | ethyl 2-(4-methylbenzamido)-4-oxo-5-{[4-(propan-2-yl)phenyl]methylidene}-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 435.54 |
| Molecular Formula: | C25 H25 N O4 S |
| Smiles: | CCOC(C1=C(NC(c2ccc(C)cc2)=O)SC(=C/c2ccc(cc2)C(C)C)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0234 |
| logD: | 3.0676 |
| logSw: | -5.5305 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.296 |
| InChI Key: | KADZSSNGPVPJGN-UHFFFAOYSA-N |