N-(3-chlorophenyl)-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide
N-(3-chlorophenyl)-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 2189-2410 |
| Compound Name: | N-(3-chlorophenyl)-6-nitro-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 344.71 |
| Molecular Formula: | C16 H9 Cl N2 O5 |
| Smiles: | C1=C(C(Nc2cccc(c2)[Cl])=O)C(=O)Oc2ccc(cc12)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5963 |
| logD: | 3.5036 |
| logSw: | -3.9883 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.633 |
| InChI Key: | BKUCLEQRHPUAHD-UHFFFAOYSA-N |