Flufylline
7-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-1,3-dimethylpurine-2,6-dione
| Molecular Formula | C21H24FN5O3 |
|---|---|
| Molecular Weight | 413.4 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 78.8 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.1863 |
| Heavy Atoms | 30 |
| Complexity | 676.0 |
Chemical Identifiers
| CAS Number | 82190-91-8 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCN3CCC(CC3)C(=O)C4=CC=C(C=C4)F |
| InChIKey | PMEYQPKJAPXGPS-UHFFFAOYSA-N |
📖 Product Overview
Flufylline (CAS: 82190-91-8) is a chemical compound with molecular formula C21H24FN5O3 and molecular weight 413.4 g/mol. Its IUPAC systematic name is 7-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-1,3-dimethylpurine-2,6-dione.
PMEYQPKJAPXGPS-UHFFFAOYSA-N.
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCN3CCC(CC3)C(=O)C4=CC=C(C=C4)F.
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