3-(3-chloro-4-fluorophenyl)-2-[2-(3-hydroxy-4-methoxyphenyl)ethenyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(3-chloro-4-fluorophenyl)-2-[2-(3-hydroxy-4-methoxyphenyl)ethenyl]quinazolin-4(3H)-one
3-(3-chloro-4-fluorophenyl)-2-[2-(3-hydroxy-4-methoxyphenyl)ethenyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K505-0265 |
| Compound Name: | 3-(3-chloro-4-fluorophenyl)-2-[2-(3-hydroxy-4-methoxyphenyl)ethenyl]quinazolin-4(3H)-one |
| Molecular Weight: | 422.84 |
| Molecular Formula: | C23 H16 Cl F N2 O3 |
| Smiles: | COc1ccc(/C=C/C2=Nc3ccccc3C(N2c2ccc(c(c2)[Cl])F)=O)cc1O |
| Stereo: | ACHIRAL |
| logP: | 4.1344 |
| logD: | 4.1283 |
| logSw: | -4.2804 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.773 |
| InChI Key: | ZROKELVOAFLTIC-YRNVUSSQSA-N |