HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 68465651Generated: October 23, 2026
1-{4-[2-(2-Methyl-5-oxo-4,4-diphenyl-4,5-dihydro-imidazol-1-yl)-acetyl]-phenyl}-3-(4-nitro-phenyl)-urea
https://huagongshe.com/en/chemical/68465651
Identifiers & Physical Properties
| Molecular formula | C31H25N5O5 |
|---|
| Average molar mass | 547.6 g/mol |
|---|
| SMILES | CC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1CC(=O)c1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 |
|---|
| InChIKey | NHSDFIXXMXZREE-UHFFFAOYSA-N |
|---|
| PubChem CID | 68465651 |
|---|
Chemical & Physical Properties
| XLogP | 4.4 |
|---|
| Topological polar surface area | 137 |
|---|
| Hydrogen bond donors | 2 |
|---|
| Hydrogen bond acceptors | 6 |
|---|
| Rotatable bonds | 7 |
|---|
| Heavy atoms | 41 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 979 |
|---|
![1-{4-[2-(2-Methyl-5-oxo-4,4-diphenyl-4,5-dihydro-imidazol-1-yl)-acetyl]-phenyl}-3-(4-nitro-phenyl)-urea molecular structure](/img/chemical/68465651.png)