3-(3-chloro-4-methoxyphenyl)-2-{2-[4-(methylsulfanyl)phenyl]ethenyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(3-chloro-4-methoxyphenyl)-2-{2-[4-(methylsulfanyl)phenyl]ethenyl}quinazolin-4(3H)-one
3-(3-chloro-4-methoxyphenyl)-2-{2-[4-(methylsulfanyl)phenyl]ethenyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K505-0202 |
| Compound Name: | 3-(3-chloro-4-methoxyphenyl)-2-{2-[4-(methylsulfanyl)phenyl]ethenyl}quinazolin-4(3H)-one |
| Molecular Weight: | 434.94 |
| Molecular Formula: | C24 H19 Cl N2 O2 S |
| Smiles: | COc1ccc(cc1[Cl])N1C(/C=C/c2ccc(cc2)SC)=Nc2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 5.1824 |
| logD: | 5.1822 |
| logSw: | -5.5709 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.224 |
| InChI Key: | IKYFKTMGQYLCAZ-UHFFFAOYSA-N |