HuagongsheHuagongshe Chemistry Print Report · For research reference only
(2-Amino-5-chloro-phenyl)-pyrimidin-2-yl-methanone

Identifiers & Physical Properties
| Molecular formula | C11H8ClN3O |
|---|---|
| Average molar mass | 233.65 g/mol |
| Monoisotopic mass | 233.0355896 g/mol |
| SMILES | Nc1ccc(Cl)cc1C(=O)c1ncccn1 |
| InChIKey | TYRGAVXBIPMIGQ-UHFFFAOYSA-N |
| PubChem CID | 12377814 |
Chemical & Physical Properties
| XLogP | 2.4 |
|---|---|
| Topological polar surface area | 68.9 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 2 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 256 |