5-{[5-(4-acetylphenyl)furan-2-yl]methylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Chemical Structure Depiction of
5-{[5-(4-acetylphenyl)furan-2-yl]methylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
5-{[5-(4-acetylphenyl)furan-2-yl]methylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 5941-1952 |
| Compound Name: | 5-{[5-(4-acetylphenyl)furan-2-yl]methylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile |
| Molecular Weight: | 346.34 |
| Molecular Formula: | C20 H14 N2 O4 |
| Smiles: | CC1/C(=C/c2ccc(c3ccc(cc3)C(C)=O)o2)C(NC(C=1C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3484 |
| logD: | 0.7596 |
| logSw: | -2.8785 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.091 |
| InChI Key: | KNGOHZSJNAXLKY-UHFFFAOYSA-N |