2-[2-(5-bromo-2-hydroxyphenyl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[2-(5-bromo-2-hydroxyphenyl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one
2-[2-(5-bromo-2-hydroxyphenyl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 3379-0124 |
| Compound Name: | 2-[2-(5-bromo-2-hydroxyphenyl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 464.27 |
| Molecular Formula: | C22 H14 Br N3 O4 |
| Smiles: | C(=C/c1cc(ccc1O)[Br])\C1=Nc2ccccc2C(N1c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4601 |
| logD: | 4.4511 |
| logSw: | -4.2188 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.524 |
| InChI Key: | XBEISTIIFNDFMA-UHFFFAOYSA-N |