HuagongsheHuagongshe Chemistry Print Report · For research reference only
Cycloguanil
WR-5473 · Chlorazin · Aids007020 · Aids-007020 · Cycloguanil · Cycloguanyl · Cycloguanil-d6 · Cycloguanil HCl
Identifiers & Physical Properties
| CAS No. | 516-21-2 |
|---|---|
| Molecular formula | C11H14ClN5 |
| Average molar mass | 251.71 g/mol |
| Monoisotopic mass | 251.09377313 g/mol |
| SMILES | CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1 |
| InChIKey | QMNFFXRFOJIOKZ-UHFFFAOYSA-N |
| PubChem CID | 9049 |
| ChEMBL | CHEMBL747 |
| ChEBI | CHEBI:135029 |
| DTXSID | DTXSID9022867 |
Chemical & Physical Properties
| XLogP | 1 |
|---|---|
| Topological polar surface area | 80 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 1 |
| Rotatable bonds | 1 |
| Heavy atoms | 17 |
| Formal charge | 0 |
| Complexity | 355 |
| Drugs | Pharmaceuticals -> Metabolite of Proguanil |
| Melting point | 146° |
| Boiling point | 397.13°C (rough estimate) |
| Density | 1.2332 (rough estimate) |
| Refractive index | 1.6110 (estimate) |
| Storage conditions | Store at -20°C |
| Solubility | Soluble in DMSO |
| Physical state | Solid |
| Color | White to off-white |
| FDA UNII | 26RM326WVN |
| GHS pictogram | GHS07 |
| Signal word | Warning |
| GHS hazard statements | H315-H319 |
| GHS precautionary statements | P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313 |
Safety & Regulations
| Signal word | Warning |
|---|---|
| GHS pictogram | GHS07 |
| GHS hazard statements | H315-H319 |
| GHS precautionary statements | P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313 |
Applications & Uses
Uses
Antimalarial.