4-(3-ethoxy-4-hydroxyphenyl)-6-oxo-2-(propylsulfanyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile
Chemical Structure Depiction of
4-(3-ethoxy-4-hydroxyphenyl)-6-oxo-2-(propylsulfanyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile
4-(3-ethoxy-4-hydroxyphenyl)-6-oxo-2-(propylsulfanyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 2188-1943 |
| Compound Name: | 4-(3-ethoxy-4-hydroxyphenyl)-6-oxo-2-(propylsulfanyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile |
| Molecular Weight: | 332.42 |
| Molecular Formula: | C17 H20 N2 O3 S |
| Smiles: | CCCSC1=C(C#N)C(CC(N1)=O)c1ccc(c(c1)OCC)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5847 |
| logD: | 2.5273 |
| logSw: | -2.9803 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.946 |
| InChI Key: | MERBESJERSGMSD-GFCCVEGCSA-N |