3-{2-[3-(3-chloro-2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethenyl}phenyl acetate
Chemical Structure Depiction of
3-{2-[3-(3-chloro-2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethenyl}phenyl acetate
3-{2-[3-(3-chloro-2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethenyl}phenyl acetate
Compound characteristics
Compound ID: | K505-0878 |
Compound Name: | 3-{2-[3-(3-chloro-2-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethenyl}phenyl acetate |
Molecular Weight: | 430.89 |
Molecular Formula: | C25 H19 Cl N2 O3 |
Smiles: | CC(=O)Oc1cccc(/C=C/C2=Nc3ccccc3C(N2c2cccc(c2C)[Cl])=O)c1 |
Stereo: | ACHIRAL |
logP: | 4.672 |
logD: | 4.6718 |
logSw: | -4.9095 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 45.044 |
InChI Key: | ZKEFXTSKXQOWOL-UHFFFAOYSA-N |