4-(2-ethoxyphenyl)-2-oxo-6-(propylsulfanyl)-1,2,3,4-tetrahydropyridine-3,5-dicarbonitrile
Chemical Structure Depiction of
4-(2-ethoxyphenyl)-2-oxo-6-(propylsulfanyl)-1,2,3,4-tetrahydropyridine-3,5-dicarbonitrile
4-(2-ethoxyphenyl)-2-oxo-6-(propylsulfanyl)-1,2,3,4-tetrahydropyridine-3,5-dicarbonitrile
Compound characteristics
| Compound ID: | 3329-3801 |
| Compound Name: | 4-(2-ethoxyphenyl)-2-oxo-6-(propylsulfanyl)-1,2,3,4-tetrahydropyridine-3,5-dicarbonitrile |
| Molecular Weight: | 341.43 |
| Molecular Formula: | C18 H19 N3 O2 S |
| Smiles: | CCCSC1=C(C#N)C(C(C#N)C(N1)=O)c1ccccc1OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0114 |
| logD: | 2.954 |
| logSw: | -3.3389 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.51 |
| InChI Key: | HSABLHXYGLDNPP-UHFFFAOYSA-N |