HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 71270505Generated: October 27, 2026
N-{4-[(3R)-3-dimethylaminopyrrolidin-1-yl]-2-methoxy-5-nitrophenyl}-4-(1H-indol-3-yl)pyrimidin-2-amine
https://huagongshe.com/en/chemical/71270505
Identifiers & Physical Properties
| Molecular formula | C25H27N7O3 |
|---|
| Average molar mass | 473.5 g/mol |
|---|
| SMILES | COc1cc(N2CC[C@@H](N(C)C)C2)c([N+](=O)[O-])cc1Nc1nccc(-c2c[nH]c3ccccc23)n1 |
|---|
| InChIKey | HULRRFGCVITTOX-MRXNPFEDSA-N |
|---|
| PubChem CID | 71270505 |
|---|
Chemical & Physical Properties
| XLogP | 4 |
|---|
| Topological polar surface area | 115 |
|---|
| Hydrogen bond donors | 2 |
|---|
| Hydrogen bond acceptors | 8 |
|---|
| Rotatable bonds | 6 |
|---|
| Heavy atoms | 35 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 722 |
|---|
![N-{4-[(3R)-3-dimethylaminopyrrolidin-1-yl]-2-methoxy-5-nitrophenyl}-4-(1H-indol-3-yl)pyrimidin-2-amine molecular structure](/img/chemical/71270505.png)