2-[2-(4-methoxyphenyl)ethenyl]-3-(3-nitrophenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[2-(4-methoxyphenyl)ethenyl]-3-(3-nitrophenyl)quinazolin-4(3H)-one
2-[2-(4-methoxyphenyl)ethenyl]-3-(3-nitrophenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K505-0341 |
| Compound Name: | 2-[2-(4-methoxyphenyl)ethenyl]-3-(3-nitrophenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 399.4 |
| Molecular Formula: | C23 H17 N3 O4 |
| Smiles: | COc1ccc(/C=C/C2=Nc3ccccc3C(N2c2cccc(c2)[N+]([O-])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9454 |
| logD: | 3.9452 |
| logSw: | -4.1974 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.519 |
| InChI Key: | UGCNOHVPIZJYMA-UHFFFAOYSA-N |