N-(4-nitrophenyl)-2-oxo-8-(prop-2-en-1-yl)-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(4-nitrophenyl)-2-oxo-8-(prop-2-en-1-yl)-2H-1-benzopyran-3-carboxamide
N-(4-nitrophenyl)-2-oxo-8-(prop-2-en-1-yl)-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 2512-1552 |
| Compound Name: | N-(4-nitrophenyl)-2-oxo-8-(prop-2-en-1-yl)-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 350.33 |
| Molecular Formula: | C19 H14 N2 O5 |
| Smiles: | C=CCc1cccc2C=C(C(Nc3ccc(cc3)[N+]([O-])=O)=O)C(=O)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 3.9174 |
| logD: | 3.3507 |
| logSw: | -4.3642 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.317 |
| InChI Key: | KICWUFCOQSEIFG-UHFFFAOYSA-N |