N-(4-fluoro-3-nitrophenyl)-1-oxo-4-phenyl-1H-2-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(4-fluoro-3-nitrophenyl)-1-oxo-4-phenyl-1H-2-benzopyran-3-carboxamide
N-(4-fluoro-3-nitrophenyl)-1-oxo-4-phenyl-1H-2-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K953-0508 |
| Compound Name: | N-(4-fluoro-3-nitrophenyl)-1-oxo-4-phenyl-1H-2-benzopyran-3-carboxamide |
| Molecular Weight: | 404.35 |
| Molecular Formula: | C22 H13 F N2 O5 |
| Smiles: | c1ccc(cc1)C1=C(C(Nc2ccc(c(c2)[N+]([O-])=O)F)=O)OC(c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1313 |
| logD: | 3.8656 |
| logSw: | -4.5741 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.14 |
| InChI Key: | FLQCVQSDHNEYFL-UHFFFAOYSA-N |