HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-Methyl-7-(2-(5-nitro-2-furyl)vinyl)-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate
1-methyl-7-(2-(5-nitro-2-furyl)vinyl)-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate · 1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-1-methyl-7-[2-(5-nitro-2-furanyl)ethenyl]-4-oxo-
Identifiers & Physical Properties
| CAS No. | 24235-63-0 |
|---|---|
| Molecular formula | C16H11N3O6 |
| Average molar mass | 341.27 g/mol |
| Monoisotopic mass | 341.06478508 g/mol |
| SMILES | Cn1cc(C(=O)O)c(=O)c2ccc(/C=C/c3ccc([N+](=O)[O-])o3)nc21 |
| InChIKey | GHYALFXBRYPUHB-UHFFFAOYSA-N |
| PubChem CID | 5284418 |
Chemical & Physical Properties
| XLogP | 2.2 |
|---|---|
| Topological polar surface area | 129 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 8 |
| Rotatable bonds | 3 |
| Heavy atoms | 25 |
| Formal charge | 0 |
| Complexity | 640 |