HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 67775308Generated: October 26, 2026
N-(2-amino-4-(tert-butyl)phenyl)-3-(3-((((3aR,4R,6R,6aR)-6-(4-((2,4-dimethoxybenzyl)amino)-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)methyl)(isopropyl)amino)cyclobutyl)propanamide
https://huagongshe.com/en/chemical/67775308
Identifiers & Physical Properties
| Molecular formula | C43H59N7O6 |
|---|
| Average molar mass | 770 g/mol |
|---|
| SMILES | COc1ccc(CNc2ncnc3c2ccn3[C@@H]2O[C@H](CN(C(C)C)C3CC(CCC(=O)Nc4ccc(C(C)(C)C)cc4N)C3)[C@H]3OC(C)(C)O[C@H]32)c(OC)c1 |
|---|
| InChIKey | WEWBELHKUNKZHP-GZNKMILMSA-N |
|---|
| PubChem CID | 67775308 |
|---|
Chemical & Physical Properties
| XLogP | 6.3 |
|---|
| Topological polar surface area | 147 |
|---|
| Hydrogen bond donors | 3 |
|---|
| Hydrogen bond acceptors | 11 |
|---|
| Rotatable bonds | 15 |
|---|
| Heavy atoms | 56 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 1,300 |
|---|