4-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-2-(3-chlorophenyl)isoquinolin-1(2H)-one
Chemical Structure Depiction of
4-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-2-(3-chlorophenyl)isoquinolin-1(2H)-one
4-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-2-(3-chlorophenyl)isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | F982-0918 |
| Compound Name: | 4-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-2-(3-chlorophenyl)isoquinolin-1(2H)-one |
| Molecular Weight: | 443.84 |
| Molecular Formula: | C24 H14 Cl N3 O4 |
| Smiles: | C1Oc2ccc(cc2O1)c1nc(C2=CN(C(c3ccccc23)=O)c2cccc(c2)[Cl])on1 |
| Stereo: | ACHIRAL |
| logP: | 5.0632 |
| logD: | 5.0632 |
| logSw: | -5.1624 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.276 |
| InChI Key: | FUXRKMUAPIEKNN-UHFFFAOYSA-N |