3-(4-bromo-3-methylphenyl)-2-[2-(3,4-difluorophenyl)ethenyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(4-bromo-3-methylphenyl)-2-[2-(3,4-difluorophenyl)ethenyl]quinazolin-4(3H)-one
3-(4-bromo-3-methylphenyl)-2-[2-(3,4-difluorophenyl)ethenyl]quinazolin-4(3H)-one
Compound characteristics
Compound ID: | K505-0252 |
Compound Name: | 3-(4-bromo-3-methylphenyl)-2-[2-(3,4-difluorophenyl)ethenyl]quinazolin-4(3H)-one |
Molecular Weight: | 453.28 |
Molecular Formula: | C23 H15 Br F2 N2 O |
Smiles: | Cc1cc(ccc1[Br])N1C(/C=C/c2ccc(c(c2)F)F)=Nc2ccccc2C1=O |
Stereo: | ACHIRAL |
logP: | 5.9044 |
logD: | 5.9029 |
logSw: | -5.6074 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 24.5941 |
InChI Key: | GWXPDNWBNCYIOI-UHFFFAOYSA-N |