2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-6-phenylpyridazin-3(2H)-one
Chemical Structure Depiction of
2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-6-phenylpyridazin-3(2H)-one
2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-6-phenylpyridazin-3(2H)-one
Compound characteristics
| Compound ID: | M455-0037 |
| Compound Name: | 2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]ethyl}-6-phenylpyridazin-3(2H)-one |
| Molecular Weight: | 388.38 |
| Molecular Formula: | C21 H16 N4 O4 |
| Smiles: | C(CN1C(C=CC(c2ccccc2)=N1)=O)c1nc(c2ccc3c(c2)OCO3)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.9529 |
| logD: | 3.9529 |
| logSw: | -4.2861 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.984 |
| InChI Key: | HZGFBKGJPFIROD-UHFFFAOYSA-N |