2-[2-(2-chloro-6-fluorophenyl)ethenyl]-3-(4-methylphenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[2-(2-chloro-6-fluorophenyl)ethenyl]-3-(4-methylphenyl)quinazolin-4(3H)-one
2-[2-(2-chloro-6-fluorophenyl)ethenyl]-3-(4-methylphenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K505-0159 |
| Compound Name: | 2-[2-(2-chloro-6-fluorophenyl)ethenyl]-3-(4-methylphenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 390.84 |
| Molecular Formula: | C23 H16 Cl F N2 O |
| Smiles: | Cc1ccc(cc1)N1C(/C=C/c2c(cccc2[Cl])F)=Nc2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 4.683 |
| logD: | 4.6829 |
| logSw: | -4.8739 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.5941 |
| InChI Key: | KHRSUKWMOJEMKI-UHFFFAOYSA-N |