C12H7ClFN3 — CID 104573626
2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine (PubChem CID 104573626) has the molecular formula C12H7ClFN3 and a molecular weight of 247.66 g/mol. Its IUPAC name is 2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine.
| Compound Name | 2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine |
|---|---|
| PubChem CID | 104573626 |
| Molecular Formula | C12H7ClFN3 |
| Molecular Weight | 247.66 g/mol |
| Exact Mass | 247.03 |
| IUPAC Name | 2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine |
| SMILES | Fc1ccc(-c2cn3ccncc3n2)cc1Cl |
| InChI | InChI=1S/C12H7ClFN3/c13-9-5-8(1-2-10(9)14)11-7-17-4-3-15-6-12(17)16-11/h1-7H |
| InChIKey | AOGYNRCLSYGKFV-UHFFFAOYSA-N |
| XLogP | 3.19 |
| TPSA | 30.19 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 17 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 247.66 |
| LogP ≤ 5 | 3.19 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |