4-hydroxy-N-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
4-hydroxy-N-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
4-hydroxy-N-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 0672-0377 |
| Compound Name: | 4-hydroxy-N-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 326.26 |
| Molecular Formula: | C16 H10 N2 O6 |
| Smiles: | c1ccc2c(c1)C(=C(C(Nc1cccc(c1)[N+]([O-])=O)=O)C(=O)O2)O |
| Stereo: | ACHIRAL |
| logP: | 2.1536 |
| logD: | -3.2455 |
| logSw: | -3.2145 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.704 |
| InChI Key: | FNDIXALEVBRVRC-UHFFFAOYSA-N |