2-[2-(2-nitrophenyl)ethenyl]-3-[3-(trifluoromethyl)phenyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[2-(2-nitrophenyl)ethenyl]-3-[3-(trifluoromethyl)phenyl]quinazolin-4(3H)-one
2-[2-(2-nitrophenyl)ethenyl]-3-[3-(trifluoromethyl)phenyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 1999-0094 |
| Compound Name: | 2-[2-(2-nitrophenyl)ethenyl]-3-[3-(trifluoromethyl)phenyl]quinazolin-4(3H)-one |
| Molecular Weight: | 437.38 |
| Molecular Formula: | C23 H14 F3 N3 O3 |
| Smiles: | C(=C/c1ccccc1[N+]([O-])=O)\C1=Nc2ccccc2C(N1c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6452 |
| logD: | 4.6443 |
| logSw: | -4.8787 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.675 |
| InChI Key: | QNYGUZXNTYIMHW-UHFFFAOYSA-N |