methyl 4-{2-[2-(3-bromophenyl)ethenyl]-4-oxoquinazolin-3(4H)-yl}benzoate
Chemical Structure Depiction of
methyl 4-{2-[2-(3-bromophenyl)ethenyl]-4-oxoquinazolin-3(4H)-yl}benzoate
methyl 4-{2-[2-(3-bromophenyl)ethenyl]-4-oxoquinazolin-3(4H)-yl}benzoate
Compound characteristics
| Compound ID: | K505-0486 |
| Compound Name: | methyl 4-{2-[2-(3-bromophenyl)ethenyl]-4-oxoquinazolin-3(4H)-yl}benzoate |
| Molecular Weight: | 461.31 |
| Molecular Formula: | C24 H17 Br N2 O3 |
| Smiles: | COC(c1ccc(cc1)N1C(/C=C\c2cccc(c2)[Br])=Nc2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0682 |
| logD: | 5.0679 |
| logSw: | -4.8602 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.768 |
| InChI Key: | BXZVIARIZMKEAO-UHFFFAOYSA-N |