7-hydroxy-3-(4-nitrophenyl)-4H-1-benzopyran-4-one
Chemical Structure Depiction of
7-hydroxy-3-(4-nitrophenyl)-4H-1-benzopyran-4-one
7-hydroxy-3-(4-nitrophenyl)-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | Y041-3714 |
| Compound Name: | 7-hydroxy-3-(4-nitrophenyl)-4H-1-benzopyran-4-one |
| Molecular Weight: | 283.24 |
| Molecular Formula: | C15 H9 N O5 |
| Smiles: | C1=C(C(c2ccc(cc2O1)O)=O)c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.4766 |
| logD: | 1.7412 |
| logSw: | -2.9084 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.859 |
| InChI Key: | CEESSYSSRMOMDE-UHFFFAOYSA-N |