6-methoxy-N-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-methoxy-N-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
6-methoxy-N-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 3720-0301 |
| Compound Name: | 6-methoxy-N-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 340.29 |
| Molecular Formula: | C17 H12 N2 O6 |
| Smiles: | COc1ccc2c(C=C(C(Nc3cccc(c3)[N+]([O-])=O)=O)C(=O)O2)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.9501 |
| logD: | 2.5857 |
| logSw: | -3.6105 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.177 |
| InChI Key: | OGKPENASLWGVEU-UHFFFAOYSA-N |