4-(4-chlorophenyl)-2-{[(naphthalen-1-yl)methyl]sulfanyl}-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Chemical Structure Depiction of
4-(4-chlorophenyl)-2-{[(naphthalen-1-yl)methyl]sulfanyl}-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
4-(4-chlorophenyl)-2-{[(naphthalen-1-yl)methyl]sulfanyl}-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 3448-4293 |
| Compound Name: | 4-(4-chlorophenyl)-2-{[(naphthalen-1-yl)methyl]sulfanyl}-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile |
| Molecular Weight: | 404.92 |
| Molecular Formula: | C23 H17 Cl N2 O S |
| Smiles: | C1C(C(C#N)=C(NC1=O)SCc1cccc2ccccc12)c1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3301 |
| logD: | 5.299 |
| logSw: | -6.4672 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.644 |
| InChI Key: | MJTAOIJZVUBZHA-FQEVSTJZSA-N |