N-(4-methylphenyl)-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(4-methylphenyl)-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide
N-(4-methylphenyl)-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 1391-0763 |
| Compound Name: | N-(4-methylphenyl)-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 324.29 |
| Molecular Formula: | C17 H12 N2 O5 |
| Smiles: | Cc1ccc(cc1)NC(C1=Cc2cc(ccc2OC1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2662 |
| logD: | 3.2644 |
| logSw: | -3.6551 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.633 |
| InChI Key: | CPCJEFUGDZMWPU-UHFFFAOYSA-N |