4,4-dimethyl-2-oxo-6-(pentylsulfanyl)-1,2,3,4-tetrahydropyridine-3,5-dicarbonitrile
Chemical Structure Depiction of
4,4-dimethyl-2-oxo-6-(pentylsulfanyl)-1,2,3,4-tetrahydropyridine-3,5-dicarbonitrile
4,4-dimethyl-2-oxo-6-(pentylsulfanyl)-1,2,3,4-tetrahydropyridine-3,5-dicarbonitrile
Compound characteristics
| Compound ID: | 8012-8429 |
| Compound Name: | 4,4-dimethyl-2-oxo-6-(pentylsulfanyl)-1,2,3,4-tetrahydropyridine-3,5-dicarbonitrile |
| Molecular Weight: | 277.39 |
| Molecular Formula: | C14 H19 N3 O S |
| Smiles: | CCCCCSC1=C(C#N)C(C)(C)C(C#N)C(N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5237 |
| logD: | 3.501 |
| logSw: | -3.4673 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.572 |
| InChI Key: | AZKASOGCWJDADQ-JTQLQIEISA-N |