Xanthinol
7-[2-hydroxy-3-[2-hydroxyethyl(methyl)amino]propyl]-1,3-dimethylpurine-2,6-dione
| Molecular Formula | C13H21N5O4 |
|---|---|
| Molecular Weight | 311.34 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 102.0 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 311.15936 |
| Heavy Atoms | 22 |
| Complexity | 435.0 |
Chemical Identifiers
| CAS Number | 2530-97-4 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(CN(C)CCO)O |
| InChIKey | DSFGXPJYDCSWTA-UHFFFAOYSA-N |
📖 Product Overview
Xanthinol (CAS: 2530-97-4) is a chemical compound with molecular formula C13H21N5O4 and molecular weight 311.34 g/mol. Its IUPAC systematic name is 7-[2-hydroxy-3-[2-hydroxyethyl(methyl)amino]propyl]-1,3-dimethylpurine-2,6-dione.
DSFGXPJYDCSWTA-UHFFFAOYSA-N.
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(CN(C)CCO)O.
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