N-(4-methoxyphenyl)-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide
N-(4-methoxyphenyl)-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K219-0303 |
| Compound Name: | N-(4-methoxyphenyl)-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 340.29 |
| Molecular Formula: | C17 H12 N2 O6 |
| Smiles: | COc1ccc(cc1)NC(C1=Cc2cc(ccc2OC1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8252 |
| logD: | 2.8223 |
| logSw: | -3.697 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.177 |
| InChI Key: | GNTBJQSQIQMKAV-UHFFFAOYSA-N |