1-(3-bromophenyl)-3-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}pyridazin-4(1H)-one
Chemical Structure Depiction of
1-(3-bromophenyl)-3-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}pyridazin-4(1H)-one
1-(3-bromophenyl)-3-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}pyridazin-4(1H)-one
Compound characteristics
| Compound ID: | M115-1577 |
| Compound Name: | 1-(3-bromophenyl)-3-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}pyridazin-4(1H)-one |
| Molecular Weight: | 441.3 |
| Molecular Formula: | C19 H13 Br N4 O2 S |
| Smiles: | CSc1ccc(cc1)c1nc(C2C(C=CN(c3cccc(c3)[Br])N=2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 5.2879 |
| logD: | 5.2879 |
| logSw: | -5.3957 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.055 |
| InChI Key: | XUWSBYMTROHTRP-UHFFFAOYSA-N |