7-chloro-2-{2-[4-(difluoromethoxy)phenyl]ethenyl}-3-(3-nitrophenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
7-chloro-2-{2-[4-(difluoromethoxy)phenyl]ethenyl}-3-(3-nitrophenyl)quinazolin-4(3H)-one
7-chloro-2-{2-[4-(difluoromethoxy)phenyl]ethenyl}-3-(3-nitrophenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K505-0833 |
| Compound Name: | 7-chloro-2-{2-[4-(difluoromethoxy)phenyl]ethenyl}-3-(3-nitrophenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 469.83 |
| Molecular Formula: | C23 H14 Cl F2 N3 O4 |
| Smiles: | C(=C/c1ccc(cc1)OC(F)F)\C1=Nc2cc(ccc2C(N1c1cccc(c1)[N+]([O-])=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8577 |
| logD: | 4.8576 |
| logSw: | -5.1893 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.581 |
| InChI Key: | PITMYQYPQRSYHC-UHFFFAOYSA-N |