HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 11607281Generated: October 23, 2026
2-(4-{(4S,5R)-4,5-Bis-(4-chloro-phenyl)-2-[4-(cyano-dimethyl-methyl)-2-ethoxy-phenyl]-4,5-dihydro-imidazole-1-carbonyl}-piperazin-1-yl)-N-(2-cyano-ethyl)-N-methyl-acetamide
https://huagongshe.com/en/chemical/11607281
Identifiers & Physical Properties
| Molecular formula | C38H41Cl2N7O3 |
|---|
| Average molar mass | 714.7 g/mol |
|---|
| SMILES | CCOc1cc(C(C)(C)C#N)ccc1C1=N[C@@H](c2ccc(Cl)cc2)[C@@H](c2ccc(Cl)cc2)N1C(=O)N1CCN(CC(=O)N(C)CCC#N)CC1 |
|---|
| InChIKey | LXGQYLKQMKFFLQ-OIDHKYIRSA-N |
|---|
| PubChem CID | 11607281 |
|---|
Chemical & Physical Properties
| XLogP | 5.3 |
|---|
| Topological polar surface area | 116 |
|---|
| Hydrogen bond donors | 0 |
|---|
| Hydrogen bond acceptors | 7 |
|---|
| Rotatable bonds | 10 |
|---|
| Heavy atoms | 50 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 1,300 |
|---|
![2-(4-{(4S,5R)-4,5-Bis-(4-chloro-phenyl)-2-[4-(cyano-dimethyl-methyl)-2-ethoxy-phenyl]-4,5-dihydro-imidazole-1-carbonyl}-piperazin-1-yl)-N-(2-cyano-ethyl)-N-methyl-acetamide molecular structure](/img/chemical/11607281.png)