HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-[4-(5-Bromo-3-pyridinyl)piperazin-1-yl]ethanone
![1-[4-(5-Bromo-3-pyridinyl)piperazin-1-yl]ethanone molecular structure](/img/chemical/91903014.png)
Identifiers & Physical Properties
| Molecular formula | C11H14BrN3O |
|---|---|
| Average molar mass | 284.15 g/mol |
| Monoisotopic mass | 283.03202 g/mol |
| SMILES | CC(=O)N1CCN(c2cncc(Br)c2)CC1 |
| InChIKey | NKPRUTXDPVEOQW-UHFFFAOYSA-N |
| PubChem CID | 91903014 |
Chemical & Physical Properties
| XLogP | 0.9 |
|---|---|
| Topological polar surface area | 36.4 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 1 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 254 |