3-(2H-1,3-benzodioxol-5-yl)-6-({[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)pyridazine
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-6-({[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)pyridazine
3-(2H-1,3-benzodioxol-5-yl)-6-({[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)pyridazine
Compound characteristics
Compound ID: | F840-0158 |
Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-6-({[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)pyridazine |
Molecular Weight: | 424.86 |
Molecular Formula: | C20 H13 Cl N4 O3 S |
Smiles: | C1Oc2ccc(cc2O1)c1ccc(nn1)SCc1nc(c2ccc(cc2)[Cl])no1 |
Stereo: | ACHIRAL |
logP: | 5.2961 |
logD: | 5.2959 |
logSw: | -6.1448 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 69.258 |
InChI Key: | BRSVHKGBDHQDQM-UHFFFAOYSA-N |