Pimefyllin
1,3-dimethyl-7-[2-(pyridin-3-ylmethylamino)ethyl]purine-2,6-dione
| Molecular Formula | C15H18N6O2 |
|---|---|
| Molecular Weight | 314.34 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 83.4 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 314.1491 |
| Heavy Atoms | 23 |
| Complexity | 459.0 |
Chemical Identifiers
| CAS Number | 10001-43-1 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCNCC3=CN=CC=C3 |
| InChIKey | CDHVRXOLGDSJGX-UHFFFAOYSA-N |
📖 Product Overview
Pimefyllin (CAS: 10001-43-1) is a chemical compound with molecular formula C15H18N6O2 and molecular weight 314.34 g/mol. Its IUPAC systematic name is 1,3-dimethyl-7-[2-(pyridin-3-ylmethylamino)ethyl]purine-2,6-dione.
CDHVRXOLGDSJGX-UHFFFAOYSA-N.
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCNCC3=CN=CC=C3.
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