4-{3-[4-(benzyloxy)phenyl]-1,2,4-oxadiazol-5-yl}-2-(3,4-dimethylphenyl)isoquinolin-1(2H)-one
Chemical Structure Depiction of
4-{3-[4-(benzyloxy)phenyl]-1,2,4-oxadiazol-5-yl}-2-(3,4-dimethylphenyl)isoquinolin-1(2H)-one
4-{3-[4-(benzyloxy)phenyl]-1,2,4-oxadiazol-5-yl}-2-(3,4-dimethylphenyl)isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | F982-0718 |
| Compound Name: | 4-{3-[4-(benzyloxy)phenyl]-1,2,4-oxadiazol-5-yl}-2-(3,4-dimethylphenyl)isoquinolin-1(2H)-one |
| Molecular Weight: | 499.57 |
| Molecular Formula: | C32 H25 N3 O3 |
| Smiles: | Cc1ccc(cc1C)N1C=C(c2ccccc2C1=O)c1nc(c2ccc(cc2)OCc2ccccc2)no1 |
| Stereo: | ACHIRAL |
| logP: | 7.0499 |
| logD: | 7.0499 |
| logSw: | -5.6947 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.388 |
| InChI Key: | WOVYFAVQSQHQNI-UHFFFAOYSA-N |