HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 59855851Generated: October 23, 2026
1h-Pyrrolo[2,3-c]pyridine-5-carboxylic acid,1-[(4-fluorophenyl)methyl]-3-[[(tetrahydro-2h-pyran-4-yl)oxy]methyl]-
https://huagongshe.com/en/chemical/59855851
Identifiers & Physical Properties
| Molecular formula | C21H21FN2O4 |
|---|
| Average molar mass | 384.4 g/mol |
|---|
| SMILES | O=C(O)c1cc2c(COC3CCOCC3)cn(Cc3ccc(F)cc3)c2cn1 |
|---|
| InChIKey | BOKLAXFYTPVDOA-UHFFFAOYSA-N |
|---|
| PubChem CID | 59855851 |
|---|
Chemical & Physical Properties
| XLogP | 2.5 |
|---|
| Topological polar surface area | 73.6 |
|---|
| Hydrogen bond donors | 1 |
|---|
| Hydrogen bond acceptors | 6 |
|---|
| Rotatable bonds | 6 |
|---|
| Heavy atoms | 28 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 523 |
|---|
![1h-Pyrrolo[2,3-c]pyridine-5-carboxylic acid,1-[(4-fluorophenyl)methyl]-3-[[(tetrahydro-2h-pyran-4-yl)oxy]methyl]- molecular structure](/img/chemical/59855851.png)