2-[2-(4-fluorophenyl)ethenyl]-6,7-dimethoxy-3-[3-(trifluoromethyl)phenyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[2-(4-fluorophenyl)ethenyl]-6,7-dimethoxy-3-[3-(trifluoromethyl)phenyl]quinazolin-4(3H)-one
2-[2-(4-fluorophenyl)ethenyl]-6,7-dimethoxy-3-[3-(trifluoromethyl)phenyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K505-0515 |
| Compound Name: | 2-[2-(4-fluorophenyl)ethenyl]-6,7-dimethoxy-3-[3-(trifluoromethyl)phenyl]quinazolin-4(3H)-one |
| Molecular Weight: | 470.42 |
| Molecular Formula: | C25 H18 F4 N2 O3 |
| Smiles: | COc1cc2C(N(C(/C=C\c3ccc(cc3)F)=Nc2cc1OC)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2286 |
| logD: | 5.2251 |
| logSw: | -5.2574 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.855 |
| InChI Key: | BNHRPVJCKYXQHJ-UHFFFAOYSA-N |