2,2'-{1,4-phenylenebis[(2-oxoethane-2,1-diyl)sulfanediyl]}bis(4,5,6-trimethylpyridine-3-carbonitrile)
Chemical Structure Depiction of
2,2'-{1,4-phenylenebis[(2-oxoethane-2,1-diyl)sulfanediyl]}bis(4,5,6-trimethylpyridine-3-carbonitrile)
2,2'-{1,4-phenylenebis[(2-oxoethane-2,1-diyl)sulfanediyl]}bis(4,5,6-trimethylpyridine-3-carbonitrile)
Compound characteristics
| Compound ID: | 8008-8153 |
| Compound Name: | 2,2'-{1,4-phenylenebis[(2-oxoethane-2,1-diyl)sulfanediyl]}bis(4,5,6-trimethylpyridine-3-carbonitrile) |
| Molecular Weight: | 514.67 |
| Molecular Formula: | C28 H26 N4 O2 S2 |
| Smiles: | Cc1c(C)c(C)nc(c1C#N)SCC(c1ccc(cc1)C(CSc1c(C#N)c(C)c(C)c(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5671 |
| logD: | 5.5671 |
| logSw: | -5.5453 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.95 |
| InChI Key: | XXEURXUSBCLDCT-UHFFFAOYSA-N |