2,2'-[methylenebis(sulfanediyl)]bis[4-(2-chlorophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile]
Chemical Structure Depiction of
2,2'-[methylenebis(sulfanediyl)]bis[4-(2-chlorophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile]
2,2'-[methylenebis(sulfanediyl)]bis[4-(2-chlorophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile]
Compound characteristics
| Compound ID: | 4296-0656 |
| Compound Name: | 2,2'-[methylenebis(sulfanediyl)]bis[4-(2-chlorophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile] |
| Molecular Weight: | 541.48 |
| Molecular Formula: | C25 H18 Cl2 N4 O2 S2 |
| Smiles: | C1C(C(C#N)=C(NC1=O)SCSC1=C(C#N)C(CC(N1)=O)c1ccccc1[Cl])c1ccccc1[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7733 |
| logD: | 4.6326 |
| logSw: | -4.8866 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.864 |
| InChI Key: | VKOUTMOJGUIHEU-UHFFFAOYSA-N |