5-{[5-(3-chloro-2-methylphenyl)furan-2-yl]methylidene}-1,4-dimethyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Chemical Structure Depiction of
5-{[5-(3-chloro-2-methylphenyl)furan-2-yl]methylidene}-1,4-dimethyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
5-{[5-(3-chloro-2-methylphenyl)furan-2-yl]methylidene}-1,4-dimethyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 4243-0277 |
| Compound Name: | 5-{[5-(3-chloro-2-methylphenyl)furan-2-yl]methylidene}-1,4-dimethyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile |
| Molecular Weight: | 366.8 |
| Molecular Formula: | C20 H15 Cl N2 O3 |
| Smiles: | CC1/C(=C\c2ccc(c3cccc(c3C)[Cl])o2)C(N(C)C(C=1C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8949 |
| logD: | 3.8949 |
| logSw: | -4.2847 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.789 |
| InChI Key: | XZOSPEPGIDDICG-UHFFFAOYSA-N |