2-{3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-6-oxopyridazin-1(6H)-yl}-N-benzylacetamide
Chemical Structure Depiction of
2-{3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-6-oxopyridazin-1(6H)-yl}-N-benzylacetamide
2-{3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-6-oxopyridazin-1(6H)-yl}-N-benzylacetamide
Compound characteristics
| Compound ID: | P040-2619 |
| Compound Name: | 2-{3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-6-oxopyridazin-1(6H)-yl}-N-benzylacetamide |
| Molecular Weight: | 431.41 |
| Molecular Formula: | C22 H17 N5 O5 |
| Smiles: | C(c1ccccc1)NC(CN1C(C=CC(c2nc(c3ccc4c(c3)OCO4)no2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9291 |
| logD: | 2.9291 |
| logSw: | -3.384 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.812 |
| InChI Key: | AODRGPNCOKRZRM-UHFFFAOYSA-N |