3-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-6-[4-(propan-2-yl)phenyl]pyridazine
Chemical Structure Depiction of
3-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-6-[4-(propan-2-yl)phenyl]pyridazine
3-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-6-[4-(propan-2-yl)phenyl]pyridazine
Compound characteristics
| Compound ID: | F840-0549 |
| Compound Name: | 3-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-6-[4-(propan-2-yl)phenyl]pyridazine |
| Molecular Weight: | 432.5 |
| Molecular Formula: | C23 H20 N4 O3 S |
| Smiles: | CC(C)c1ccc(cc1)c1ccc(nn1)SCc1nc(c2ccc3c(c2)OCO3)no1 |
| Stereo: | ACHIRAL |
| logP: | 6.1614 |
| logD: | 6.1613 |
| logSw: | -5.6732 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.258 |
| InChI Key: | BKBJYBRJMJMBFE-UHFFFAOYSA-N |