2-[2-(4-hydroxy-3-methoxyphenyl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[2-(4-hydroxy-3-methoxyphenyl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one
2-[2-(4-hydroxy-3-methoxyphenyl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 2764-0014 |
| Compound Name: | 2-[2-(4-hydroxy-3-methoxyphenyl)ethenyl]-3-(4-nitrophenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 415.4 |
| Molecular Formula: | C23 H17 N3 O5 |
| Smiles: | COc1cc(/C=C/C2=Nc3ccccc3C(N2c2ccc(cc2)[N+]([O-])=O)=O)ccc1O |
| Stereo: | ACHIRAL |
| logP: | 3.3026 |
| logD: | 3.2974 |
| logSw: | -3.6242 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.154 |
| InChI Key: | BZWVJSBKDRWBTD-UHFFFAOYSA-N |