methyl 4-[2-(2-{4-[(3,4-dichlorophenyl)methoxy]phenyl}ethenyl)-4-oxoquinazolin-3(4H)-yl]benzoate
Chemical Structure Depiction of
methyl 4-[2-(2-{4-[(3,4-dichlorophenyl)methoxy]phenyl}ethenyl)-4-oxoquinazolin-3(4H)-yl]benzoate
methyl 4-[2-(2-{4-[(3,4-dichlorophenyl)methoxy]phenyl}ethenyl)-4-oxoquinazolin-3(4H)-yl]benzoate
Compound characteristics
| Compound ID: | K505-0882 |
| Compound Name: | methyl 4-[2-(2-{4-[(3,4-dichlorophenyl)methoxy]phenyl}ethenyl)-4-oxoquinazolin-3(4H)-yl]benzoate |
| Molecular Weight: | 557.43 |
| Molecular Formula: | C31 H22 Cl2 N2 O4 |
| Smiles: | COC(c1ccc(cc1)N1C(/C=C/c2ccc(cc2)OCc2ccc(c(c2)[Cl])[Cl])=Nc2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9599 |
| logD: | 6.9596 |
| logSw: | -6.3339 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.996 |
| InChI Key: | WCANXUPJRQFFFP-UHFFFAOYSA-N |