HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 19081900Generated: November 4, 2026
1-[4-Amino-5-chloro-2-(3,5-dimethoxybenzyloxy)-phenyl]-5-(4,4-dimethylpiperidin-1-yl)pentan-1-one
https://huagongshe.com/en/chemical/19081900
Identifiers & Physical Properties
| Molecular formula | C27H37ClN2O4 |
|---|
| Average molar mass | 489 g/mol |
|---|
| Monoisotopic mass | 488.2441854 g/mol |
|---|
| SMILES | COc1cc(COc2cc(N)c(Cl)cc2C(=O)CCCCN2CCC(C)(C)CC2)cc(OC)c1 |
|---|
| InChIKey | IWWBQYWVXTYQEC-UHFFFAOYSA-N |
|---|
| PubChem CID | 19081900 |
|---|
Chemical & Physical Properties
| XLogP | 5.3 |
|---|
| Topological polar surface area | 74 |
|---|
| Hydrogen bond donors | 1 |
|---|
| Hydrogen bond acceptors | 6 |
|---|
| Rotatable bonds | 11 |
|---|
| Heavy atoms | 34 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 612 |
|---|
![1-[4-Amino-5-chloro-2-(3,5-dimethoxybenzyloxy)-phenyl]-5-(4,4-dimethylpiperidin-1-yl)pentan-1-one molecular structure](/img/chemical/19081900.png)