2,2'-{1,4-phenylenebis[(2,5-dioxopyrrolidine-1,3-diyl)sulfanediyl]}bis[6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile]
Chemical Structure Depiction of
2,2'-{1,4-phenylenebis[(2,5-dioxopyrrolidine-1,3-diyl)sulfanediyl]}bis[6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile]
2,2'-{1,4-phenylenebis[(2,5-dioxopyrrolidine-1,3-diyl)sulfanediyl]}bis[6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile]
Compound characteristics
| Compound ID: | 8010-0044 |
| Compound Name: | 2,2'-{1,4-phenylenebis[(2,5-dioxopyrrolidine-1,3-diyl)sulfanediyl]}bis[6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile] |
| Molecular Weight: | 828.77 |
| Molecular Formula: | C40 H22 F6 N6 O4 S2 |
| Smiles: | C1C(C(N(C1=O)c1ccc(cc1)N1C(CC(C1=O)Sc1c(C#N)c(cc(c2ccccc2)n1)C(F)(F)F)=O)=O)Sc1c(C#N)c(cc(c2ccccc2)n1)C(F)(F)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.615 |
| logD: | 7.615 |
| logSw: | -6.203 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 109.141 |
| InChI Key: | INMULCJOFCFBLK-UHFFFAOYSA-N |