2-(2-{4-[(3,4-dichlorophenyl)methoxy]phenyl}ethenyl)-3-(4-nitrophenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-(2-{4-[(3,4-dichlorophenyl)methoxy]phenyl}ethenyl)-3-(4-nitrophenyl)quinazolin-4(3H)-one
2-(2-{4-[(3,4-dichlorophenyl)methoxy]phenyl}ethenyl)-3-(4-nitrophenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K505-0895 |
| Compound Name: | 2-(2-{4-[(3,4-dichlorophenyl)methoxy]phenyl}ethenyl)-3-(4-nitrophenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 544.39 |
| Molecular Formula: | C29 H19 Cl2 N3 O4 |
| Smiles: | C(c1ccc(c(c1)[Cl])[Cl])Oc1ccc(/C=C/C2=Nc3ccccc3C(N2c2ccc(cc2)[N+]([O-])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.7948 |
| logD: | 6.7945 |
| logSw: | -6.5918 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.203 |
| InChI Key: | KQYANVBNSOXFDC-UHFFFAOYSA-N |