2-(3-fluorophenyl)-4-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}isoquinolin-1(2H)-one
Chemical Structure Depiction of
2-(3-fluorophenyl)-4-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}isoquinolin-1(2H)-one
2-(3-fluorophenyl)-4-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | F982-0900 |
| Compound Name: | 2-(3-fluorophenyl)-4-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}isoquinolin-1(2H)-one |
| Molecular Weight: | 429.47 |
| Molecular Formula: | C24 H16 F N3 O2 S |
| Smiles: | CSc1ccc(cc1)c1nc(C2=CN(C(c3ccccc23)=O)c2cccc(c2)F)on1 |
| Stereo: | ACHIRAL |
| logP: | 5.2978 |
| logD: | 5.2978 |
| logSw: | -5.3568 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.16 |
| InChI Key: | ICAMGFYSCQAXFO-UHFFFAOYSA-N |