HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 135409708Generated: November 2, 2026
methyl 4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidine-7-carboxylate
https://huagongshe.com/en/chemical/135409708
Identifiers & Physical Properties
| Molecular formula | C8H7N3O3 |
|---|
| Average molar mass | 193.16 g/mol |
|---|
| Monoisotopic mass | 193.04874109 g/mol |
|---|
| SMILES | COC(=O)c1c[nH]c2c(=O)[nH]cnc12 |
|---|
| InChIKey | CWFVLWYOKBIVPG-UHFFFAOYSA-N |
|---|
| PubChem CID | 135409708 |
|---|
Chemical & Physical Properties
| XLogP | -0.3 |
|---|
| Topological polar surface area | 83.6 |
|---|
| Hydrogen bond donors | 2 |
|---|
| Hydrogen bond acceptors | 4 |
|---|
| Rotatable bonds | 2 |
|---|
| Heavy atoms | 14 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 302 |
|---|
![methyl 4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidine-7-carboxylate molecular structure](/img/chemical/135409708.png)