4-[3-(6-oxo-1,6-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]benzonitrile
Chemical Structure Depiction of
4-[3-(6-oxo-1,6-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]benzonitrile
4-[3-(6-oxo-1,6-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]benzonitrile
Compound characteristics
| Compound ID: | P029-0071 |
| Compound Name: | 4-[3-(6-oxo-1,6-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]benzonitrile |
| Molecular Weight: | 264.24 |
| Molecular Formula: | C14 H8 N4 O2 |
| Smiles: | C1=CC(NC=C1c1nc(c2ccc(C#N)cc2)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7681 |
| logD: | 1.768 |
| logSw: | -2.1218 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.41 |
| InChI Key: | GRAGRDHSFMFXHF-UHFFFAOYSA-N |