N-(2-methoxy-4-nitrophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-4-nitrophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
N-(2-methoxy-4-nitrophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 1988-1000 |
| Compound Name: | N-(2-methoxy-4-nitrophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 340.29 |
| Molecular Formula: | C17 H12 N2 O6 |
| Smiles: | COc1cc(ccc1NC(C1=Cc2ccccc2OC1=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8914 |
| logD: | 1.0105 |
| logSw: | -3.6342 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.565 |
| InChI Key: | XMXGEUAJAQDGRS-UHFFFAOYSA-N |