5-hydroxy-7-[2-(3-nitrophenyl)-2-oxoethoxy]-2-phenyl-4H-1-benzopyran-4-one
Chemical Structure Depiction of
5-hydroxy-7-[2-(3-nitrophenyl)-2-oxoethoxy]-2-phenyl-4H-1-benzopyran-4-one
5-hydroxy-7-[2-(3-nitrophenyl)-2-oxoethoxy]-2-phenyl-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | Y041-1400 |
| Compound Name: | 5-hydroxy-7-[2-(3-nitrophenyl)-2-oxoethoxy]-2-phenyl-4H-1-benzopyran-4-one |
| Molecular Weight: | 417.37 |
| Molecular Formula: | C23 H15 N O7 |
| Smiles: | C(C(c1cccc(c1)[N+]([O-])=O)=O)Oc1cc(c2C(C=C(c3ccccc3)Oc2c1)=O)O |
| Stereo: | ACHIRAL |
| logP: | 5.0929 |
| logD: | 5.0894 |
| logSw: | -5.114 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.189 |
| InChI Key: | LVWJOCFSQBHVFE-UHFFFAOYSA-N |