2-[2-(4-ethoxyphenyl)ethenyl]-6-nitro-4H-3,1-benzoxazin-4-one
Chemical Structure Depiction of
2-[2-(4-ethoxyphenyl)ethenyl]-6-nitro-4H-3,1-benzoxazin-4-one
2-[2-(4-ethoxyphenyl)ethenyl]-6-nitro-4H-3,1-benzoxazin-4-one
Compound characteristics
| Compound ID: | 8011-6443 |
| Compound Name: | 2-[2-(4-ethoxyphenyl)ethenyl]-6-nitro-4H-3,1-benzoxazin-4-one |
| Molecular Weight: | 338.32 |
| Molecular Formula: | C18 H14 N2 O5 |
| Smiles: | CCOc1ccc(/C=C/C2=Nc3ccc(cc3C(=O)O2)[N+]([O-])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6525 |
| logD: | 3.6525 |
| logSw: | -4.0365 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.837 |
| InChI Key: | CZOGZWXKHLMRMK-UHFFFAOYSA-N |