5-{5-[2-(2H-1,3-benzodioxol-5-yl)ethenyl]-1,2,4-oxadiazol-3-yl}pyridin-2(1H)-one
Chemical Structure Depiction of
5-{5-[2-(2H-1,3-benzodioxol-5-yl)ethenyl]-1,2,4-oxadiazol-3-yl}pyridin-2(1H)-one
5-{5-[2-(2H-1,3-benzodioxol-5-yl)ethenyl]-1,2,4-oxadiazol-3-yl}pyridin-2(1H)-one
Compound characteristics
| Compound ID: | P029-0116 |
| Compound Name: | 5-{5-[2-(2H-1,3-benzodioxol-5-yl)ethenyl]-1,2,4-oxadiazol-3-yl}pyridin-2(1H)-one |
| Molecular Weight: | 309.28 |
| Molecular Formula: | C16 H11 N3 O4 |
| Smiles: | C1Oc2ccc(/C=C/c3nc(C4C=CC(NC=4)=O)no3)cc2O1 |
| Stereo: | ACHIRAL |
| logP: | 2.858 |
| logD: | 2.8579 |
| logSw: | -3.3131 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.135 |
| InChI Key: | BCOQSRHFETWDBX-UHFFFAOYSA-N |