6-(2H-1,3-benzodioxol-5-yl)-2-{2-[3-(4-fluorophenyl)-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-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl}pyridazin-3(2H)-one
6-(2H-1,3-benzodioxol-5-yl)-2-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl}pyridazin-3(2H)-one
Compound characteristics
Compound ID: | M455-0330 |
Compound Name: | 6-(2H-1,3-benzodioxol-5-yl)-2-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl}pyridazin-3(2H)-one |
Molecular Weight: | 406.37 |
Molecular Formula: | C21 H15 F N4 O4 |
Smiles: | C(CN1C(C=CC(c2ccc3c(c2)OCO3)=N1)=O)c1nc(c2ccc(cc2)F)no1 |
Stereo: | ACHIRAL |
logP: | 4.0453 |
logD: | 4.0453 |
logSw: | -4.3171 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 76.984 |
InChI Key: | WVVYOKLPDAHOCD-UHFFFAOYSA-N |