5-{[5-(3-chlorophenyl)furan-2-yl]methylidene}-4-methyl-2,6-dioxo-1-(2-phenylethyl)-1,2,5,6-tetrahydropyridine-3-carbonitrile
Chemical Structure Depiction of
5-{[5-(3-chlorophenyl)furan-2-yl]methylidene}-4-methyl-2,6-dioxo-1-(2-phenylethyl)-1,2,5,6-tetrahydropyridine-3-carbonitrile
5-{[5-(3-chlorophenyl)furan-2-yl]methylidene}-4-methyl-2,6-dioxo-1-(2-phenylethyl)-1,2,5,6-tetrahydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 4995-0239 |
| Compound Name: | 5-{[5-(3-chlorophenyl)furan-2-yl]methylidene}-4-methyl-2,6-dioxo-1-(2-phenylethyl)-1,2,5,6-tetrahydropyridine-3-carbonitrile |
| Molecular Weight: | 442.9 |
| Molecular Formula: | C26 H19 Cl N2 O3 |
| Smiles: | CC1/C(=C/c2ccc(c3cccc(c3)[Cl])o2)C(N(CCc2ccccc2)C(C=1C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4584 |
| logD: | 5.4584 |
| logSw: | -5.7712 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.73 |
| InChI Key: | CKADAAXGSNJEOB-UHFFFAOYSA-N |