4-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methylphenyl)isoquinolin-1(2H)-one
Chemical Structure Depiction of
4-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methylphenyl)isoquinolin-1(2H)-one
4-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methylphenyl)isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | F982-0660 |
| Compound Name: | 4-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methylphenyl)isoquinolin-1(2H)-one |
| Molecular Weight: | 439.47 |
| Molecular Formula: | C26 H21 N3 O4 |
| Smiles: | Cc1ccc(cc1)N1C=C(c2ccccc2C1=O)c1nc(c2cc(cc(c2)OC)OC)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.8784 |
| logD: | 4.8784 |
| logSw: | -4.687 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.248 |
| InChI Key: | IAIQVXVWSJDCCK-UHFFFAOYSA-N |