HuagongsheHuagongshe Chemistry Print Report · For research reference only
diethyl (2S)-2-[(4-iodobenzoyl)amino]pentanedioate
![diethyl (2S)-2-[(4-iodobenzoyl)amino]pentanedioate molecular structure](/img/chemical/1885228.png)
Identifiers & Physical Properties
| Molecular formula | C16H20INO5 |
|---|---|
| Average molar mass | 433.24 g/mol |
| SMILES | CCOC(=O)CC[C@H](NC(=O)c1ccc(I)cc1)C(=O)OCC |
| InChIKey | RQYOVSAJDTUHDE-ZDUSSCGKSA-N |
| PubChem CID | 1885228 |
Chemical & Physical Properties
| XLogP | 2.7 |
|---|---|
| Topological polar surface area | 81.7 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 10 |
| Heavy atoms | 23 |
| Formal charge | 0 |
| Complexity | 407 |