2-(4-methoxyphenyl)-4-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}isoquinolin-1(2H)-one
Chemical Structure Depiction of
2-(4-methoxyphenyl)-4-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}isoquinolin-1(2H)-one
2-(4-methoxyphenyl)-4-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | F982-0068 |
| Compound Name: | 2-(4-methoxyphenyl)-4-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}isoquinolin-1(2H)-one |
| Molecular Weight: | 463.41 |
| Molecular Formula: | C25 H16 F3 N3 O3 |
| Smiles: | COc1ccc(cc1)N1C=C(c2ccccc2C1=O)c1nc(c2cccc(c2)C(F)(F)F)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.272 |
| logD: | 5.272 |
| logSw: | -5.4329 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.704 |
| InChI Key: | HURBFEBRLAXIPR-UHFFFAOYSA-N |