3-{2-[3-(3-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethenyl}phenyl acetate
Chemical Structure Depiction of
3-{2-[3-(3-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethenyl}phenyl acetate
3-{2-[3-(3-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethenyl}phenyl acetate
Compound characteristics
| Compound ID: | K505-0876 |
| Compound Name: | 3-{2-[3-(3-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethenyl}phenyl acetate |
| Molecular Weight: | 396.44 |
| Molecular Formula: | C25 H20 N2 O3 |
| Smiles: | CC(=O)Oc1cccc(/C=C/C2=Nc3ccccc3C(N2c2cccc(C)c2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.0616 |
| logD: | 4.0601 |
| logSw: | -4.3189 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.345 |
| InChI Key: | AXJXQUJKMSULPR-UHFFFAOYSA-N |