6-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}pyridazin-3(2H)-one
Chemical Structure Depiction of
6-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}pyridazin-3(2H)-one
6-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F839-0156 |
| Compound Name: | 6-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}pyridazin-3(2H)-one |
| Molecular Weight: | 408.8 |
| Molecular Formula: | C20 H13 Cl N4 O4 |
| Smiles: | C(c1nc(c2ccccc2[Cl])no1)N1C(C=CC(c2ccc3c(c2)OCO3)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9296 |
| logD: | 3.9296 |
| logSw: | -4.405 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 77.006 |
| InChI Key: | KBQMNMYUCDTCEK-UHFFFAOYSA-N |