2-[2-(3,4-difluorophenyl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[2-(3,4-difluorophenyl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one
2-[2-(3,4-difluorophenyl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K505-0415 |
| Compound Name: | 2-[2-(3,4-difluorophenyl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 405.36 |
| Molecular Formula: | C22 H13 F2 N3 O3 |
| Smiles: | C(=C\c1ccc(c(c1)F)F)\C1=Nc2ccccc2C(N1c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5104 |
| logD: | 4.5101 |
| logSw: | -4.6368 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.976 |
| InChI Key: | QBHZABJWXJMFJA-UHFFFAOYSA-N |