HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 13232256Generated: October 27, 2026
5-cyano-1-(N-hydroxymethyl-2,4,6-trichloroanilino)-2,4-pyrimidinedione
https://huagongshe.com/en/chemical/13232256
Identifiers & Physical Properties
| Molecular formula | C12H7Cl3N4O3 |
|---|
| Average molar mass | 361.6 g/mol |
|---|
| SMILES | N#Cc1cn(N(CO)c2c(Cl)cc(Cl)cc2Cl)c(=O)[nH]c1=O |
|---|
| InChIKey | UKZXBZPACZTOCZ-UHFFFAOYSA-N |
|---|
| PubChem CID | 13232256 |
|---|
Chemical & Physical Properties
| XLogP | 2.4 |
|---|
| Topological polar surface area | 96.7 |
|---|
| Hydrogen bond donors | 2 |
|---|
| Hydrogen bond acceptors | 5 |
|---|
| Rotatable bonds | 3 |
|---|
| Heavy atoms | 22 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 549 |
|---|
