6-(2-bromophenyl)-2-({3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)pyridazin-3(2H)-one
Chemical Structure Depiction of
6-(2-bromophenyl)-2-({3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)pyridazin-3(2H)-one
6-(2-bromophenyl)-2-({3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F839-0682 |
| Compound Name: | 6-(2-bromophenyl)-2-({3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)pyridazin-3(2H)-one |
| Molecular Weight: | 455.33 |
| Molecular Formula: | C20 H15 Br N4 O2 S |
| Smiles: | CSc1ccc(cc1)c1nc(CN2C(C=CC(c3ccccc3[Br])=N2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.8715 |
| logD: | 4.8715 |
| logSw: | -4.6376 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.89 |
| InChI Key: | CMMQDDXSPGTXMG-UHFFFAOYSA-N |