4-(2-methylphenyl)-2-{[(naphthalen-1-yl)methyl]sulfanyl}-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Chemical Structure Depiction of
4-(2-methylphenyl)-2-{[(naphthalen-1-yl)methyl]sulfanyl}-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
4-(2-methylphenyl)-2-{[(naphthalen-1-yl)methyl]sulfanyl}-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Compound characteristics
Compound ID: | 3448-4294 |
Compound Name: | 4-(2-methylphenyl)-2-{[(naphthalen-1-yl)methyl]sulfanyl}-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile |
Molecular Weight: | 384.5 |
Molecular Formula: | C24 H20 N2 O S |
Smiles: | Cc1ccccc1C1CC(NC(=C1C#N)SCc1cccc2ccccc12)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.2387 |
logD: | 5.2076 |
logSw: | -5.9398 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 40.644 |
InChI Key: | SDSMJIPOWRSGHY-OAQYLSRUSA-N |