6-(2H-1,3-benzodioxol-5-yl)-2-{2-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}pyridazin-3(2H)-one
Chemical Structure Depiction of
6-(2H-1,3-benzodioxol-5-yl)-2-{2-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}pyridazin-3(2H)-one
6-(2H-1,3-benzodioxol-5-yl)-2-{2-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | M455-0320 |
| Compound Name: | 6-(2H-1,3-benzodioxol-5-yl)-2-{2-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}pyridazin-3(2H)-one |
| Molecular Weight: | 448.43 |
| Molecular Formula: | C23 H20 N4 O6 |
| Smiles: | COc1cc(cc(c1)OC)c1nc(CCN2C(C=CC(c3ccc4c(c3)OCO4)=N2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.9833 |
| logD: | 3.9833 |
| logSw: | -4.2711 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 92.072 |
| InChI Key: | ZAFAFFPKGNJOQD-UHFFFAOYSA-N |