3-(4-methylphenyl)-2-{2-[4-(octyloxy)phenyl]ethenyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(4-methylphenyl)-2-{2-[4-(octyloxy)phenyl]ethenyl}quinazolin-4(3H)-one
3-(4-methylphenyl)-2-{2-[4-(octyloxy)phenyl]ethenyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K505-0845 |
| Compound Name: | 3-(4-methylphenyl)-2-{2-[4-(octyloxy)phenyl]ethenyl}quinazolin-4(3H)-one |
| Molecular Weight: | 466.62 |
| Molecular Formula: | C31 H34 N2 O2 |
| Smiles: | CCCCCCCCOc1ccc(/C=C/C2=Nc3ccccc3C(N2c2ccc(C)cc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 7.9814 |
| logD: | 7.9811 |
| logSw: | -5.8168 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.012 |
| InChI Key: | HORMEJVKNZOBSN-UHFFFAOYSA-N |