methyl 4-{2-[2-(naphthalen-1-yl)ethenyl]-4-oxoquinazolin-3(4H)-yl}benzoate
Chemical Structure Depiction of
methyl 4-{2-[2-(naphthalen-1-yl)ethenyl]-4-oxoquinazolin-3(4H)-yl}benzoate
methyl 4-{2-[2-(naphthalen-1-yl)ethenyl]-4-oxoquinazolin-3(4H)-yl}benzoate
Compound characteristics
Compound ID: | K505-0606 |
Compound Name: | methyl 4-{2-[2-(naphthalen-1-yl)ethenyl]-4-oxoquinazolin-3(4H)-yl}benzoate |
Molecular Weight: | 432.48 |
Molecular Formula: | C28 H20 N2 O3 |
Smiles: | COC(c1ccc(cc1)N1C(/C=C/c2cccc3ccccc23)=Nc2ccccc2C1=O)=O |
Stereo: | ACHIRAL |
logP: | 5.2151 |
logD: | 5.2143 |
logSw: | -6.0096 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 45.496 |
InChI Key: | VYZIOFVQNKBSJN-UHFFFAOYSA-N |