2-(3,4-dimethoxyphenyl)-4-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-4-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
2-(3,4-dimethoxyphenyl)-4-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | F982-0186 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-4-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one |
| Molecular Weight: | 455.47 |
| Molecular Formula: | C26 H21 N3 O5 |
| Smiles: | COc1cccc(c1)c1nc(C2=CN(C(c3ccccc23)=O)c2ccc(c(c2)OC)OC)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.2211 |
| logD: | 4.2211 |
| logSw: | -4.5733 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.965 |
| InChI Key: | IGMWAAAVEDPKKM-UHFFFAOYSA-N |