HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 6861406Generated: November 3, 2026
2-[(4-methoxybenzylidene)amino]-1H-isoindole-1,3(2H)-dione
https://huagongshe.com/en/chemical/6861406
Identifiers & Physical Properties
| CAS No. | 19279-70-0 |
|---|
| Molecular formula | C16H12N2O3 |
|---|
| Average molar mass | 280.28 g/mol |
|---|
| Monoisotopic mass | 280.08479225 g/mol |
|---|
| SMILES | COc1ccc(/C=N/N2C(=O)c3ccccc3C2=O)cc1 |
|---|
| InChIKey | MVDSIJWTEOQKTD-LICLKQGHSA-N |
|---|
| PubChem CID | 6861406 |
|---|
| ChEMBL | CHEMBL3190279 |
|---|
Chemical & Physical Properties
| XLogP | 2.5 |
|---|
| Topological polar surface area | 59 |
|---|
| Hydrogen bond donors | 0 |
|---|
| Hydrogen bond acceptors | 4 |
|---|
| Rotatable bonds | 3 |
|---|
| Heavy atoms | 21 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 417 |
|---|
![2-[(4-methoxybenzylidene)amino]-1H-isoindole-1,3(2H)-dione molecular structure](/img/chemical/6861406.png)