2-(3,4-dimethylphenyl)-4-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}phthalazin-1(2H)-one
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-4-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}phthalazin-1(2H)-one
2-(3,4-dimethylphenyl)-4-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | F990-0391 |
| Compound Name: | 2-(3,4-dimethylphenyl)-4-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}phthalazin-1(2H)-one |
| Molecular Weight: | 462.43 |
| Molecular Formula: | C25 H17 F3 N4 O2 |
| Smiles: | Cc1ccc(cc1C)N1C(c2ccccc2C(c2nc(c3cccc(c3)C(F)(F)F)no2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6123 |
| logD: | 6.6039 |
| logSw: | -5.8865 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.453 |
| InChI Key: | IXKCFDLVRYDMHS-UHFFFAOYSA-N |