3-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-2-{2-[3-(trifluoromethyl)phenyl]ethenyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-2-{2-[3-(trifluoromethyl)phenyl]ethenyl}quinazolin-4(3H)-one
3-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-2-{2-[3-(trifluoromethyl)phenyl]ethenyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K505-0545 |
| Compound Name: | 3-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-2-{2-[3-(trifluoromethyl)phenyl]ethenyl}quinazolin-4(3H)-one |
| Molecular Weight: | 516.9 |
| Molecular Formula: | C26 H20 Cl F3 N2 O4 |
| Smiles: | COc1cc2C(N(C(/C=C\c3cccc(c3)C(F)(F)F)=Nc2cc1OC)c1ccc(c(c1)[Cl])OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6618 |
| logD: | 5.6614 |
| logSw: | -6.0849 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.485 |
| InChI Key: | XPDCPRQHOSMMPR-UHFFFAOYSA-N |