HuagongsheHuagongshe Chemistry Print Report · For research reference only
N-(3-(2-pyridyldithio)propionyl)stearylamine
N-(3-(2-pyridyldithio)propionyl)stearylamine
Identifiers & Physical Properties
| CAS No. | 92279-65-7 |
|---|---|
| Molecular formula | C26H46N2OS2 |
| Average molar mass | 466.8 g/mol |
| Monoisotopic mass | 466.30515644 g/mol |
| SMILES | CCCCCCCCCCCCCCCCCCNC(=O)CCSSc1ccccn1 |
| InChIKey | ZQMCQXTUQFHAJV-UHFFFAOYSA-N |
| PubChem CID | 124792 |
| DTXSID | DTXSID90238951 |
Chemical & Physical Properties
| XLogP | 9.8 |
|---|---|
| Topological polar surface area | 92.6 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 22 |
| Heavy atoms | 31 |
| Formal charge | 0 |
| Complexity | 396 |