2-hydroxy-5-[(3-nitro-2-oxo-2H-1-benzopyran-4-yl)amino]benzoic acid
Chemical Structure Depiction of
2-hydroxy-5-[(3-nitro-2-oxo-2H-1-benzopyran-4-yl)amino]benzoic acid
2-hydroxy-5-[(3-nitro-2-oxo-2H-1-benzopyran-4-yl)amino]benzoic acid
Compound characteristics
| Compound ID: | 4882-0015 |
| Compound Name: | 2-hydroxy-5-[(3-nitro-2-oxo-2H-1-benzopyran-4-yl)amino]benzoic acid |
| Molecular Weight: | 342.26 |
| Molecular Formula: | C16 H10 N2 O7 |
| Smiles: | c1ccc2c(c1)C(=C(C(=O)O2)[N+]([O-])=O)Nc1ccc(c(c1)C(O)=O)O |
| Stereo: | ACHIRAL |
| logP: | 3.2543 |
| logD: | -0.2662 |
| logSw: | -3.5636 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 108.527 |
| InChI Key: | ZFFBJIHKWHDJHX-UHFFFAOYSA-N |