2-(4-chlorophenyl)-4-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-4-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
2-(4-chlorophenyl)-4-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | F982-0829 |
| Compound Name: | 2-(4-chlorophenyl)-4-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one |
| Molecular Weight: | 443.89 |
| Molecular Formula: | C25 H18 Cl N3 O3 |
| Smiles: | CCOc1ccc(cc1)c1nc(C2=CN(C(c3ccccc23)=O)c2ccc(cc2)[Cl])on1 |
| Stereo: | ACHIRAL |
| logP: | 5.4516 |
| logD: | 5.4516 |
| logSw: | -5.9638 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.284 |
| InChI Key: | CLHIMCGGCAJCML-UHFFFAOYSA-N |