2,2'-{1,4-phenylenebis[(2-oxoethane-2,1-diyl)sulfanediyl]}bis[6-(2-methylpropyl)pyridine-3-carbonitrile]
Chemical Structure Depiction of
2,2'-{1,4-phenylenebis[(2-oxoethane-2,1-diyl)sulfanediyl]}bis[6-(2-methylpropyl)pyridine-3-carbonitrile]
2,2'-{1,4-phenylenebis[(2-oxoethane-2,1-diyl)sulfanediyl]}bis[6-(2-methylpropyl)pyridine-3-carbonitrile]
Compound characteristics
| Compound ID: | 8009-5766 |
| Compound Name: | 2,2'-{1,4-phenylenebis[(2-oxoethane-2,1-diyl)sulfanediyl]}bis[6-(2-methylpropyl)pyridine-3-carbonitrile] |
| Molecular Weight: | 542.72 |
| Molecular Formula: | C30 H30 N4 O2 S2 |
| Smiles: | CC(C)Cc1ccc(C#N)c(n1)SCC(c1ccc(cc1)C(CSc1c(C#N)ccc(CC(C)C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8011 |
| logD: | 6.8011 |
| logSw: | -5.6706 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.787 |
| InChI Key: | YQPQLQSXGXWKFC-UHFFFAOYSA-N |