3-(4-bromo-3-methylphenyl)-6,7-dimethoxy-2-{2-[3-(trifluoromethyl)phenyl]ethenyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(4-bromo-3-methylphenyl)-6,7-dimethoxy-2-{2-[3-(trifluoromethyl)phenyl]ethenyl}quinazolin-4(3H)-one
3-(4-bromo-3-methylphenyl)-6,7-dimethoxy-2-{2-[3-(trifluoromethyl)phenyl]ethenyl}quinazolin-4(3H)-one
Compound characteristics
Compound ID: | K505-0539 |
Compound Name: | 3-(4-bromo-3-methylphenyl)-6,7-dimethoxy-2-{2-[3-(trifluoromethyl)phenyl]ethenyl}quinazolin-4(3H)-one |
Molecular Weight: | 545.36 |
Molecular Formula: | C26 H20 Br F3 N2 O3 |
Smiles: | Cc1cc(ccc1[Br])N1C(/C=C\c2cccc(c2)C(F)(F)F)=Nc2cc(c(cc2C1=O)OC)OC |
Stereo: | ACHIRAL |
logP: | 6.6062 |
logD: | 6.6028 |
logSw: | -5.9199 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 39.855 |
InChI Key: | JOVKUMOLAFENMC-UHFFFAOYSA-N |