Guaithylline
1,3-dimethyl-7H-purine-2,6-dione;3-(2-methoxyphenoxy)propane-1,2-diol
| Molecular Formula | C17H22N4O6 |
|---|---|
| Molecular Weight | 378.4 g/mol |
| Topological Polar Surface Area | 128.0 A2 |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.15393 |
| Heavy Atoms | 27 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 5634-38-8 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)NC=N2.COC1=CC=CC=C1OCC(CO)O |
| InChIKey | PVKUHCBHOUMGJN-UHFFFAOYSA-N |
📖 Product Overview
Guaithylline (CAS: 5634-38-8) is a chemical compound with molecular formula C17H22N4O6 and molecular weight 378.4 g/mol. Its IUPAC systematic name is 1,3-dimethyl-7H-purine-2,6-dione;3-(2-methoxyphenoxy)propane-1,2-diol.
PVKUHCBHOUMGJN-UHFFFAOYSA-N.
SMILES: CN1C2=C(C(=O)N(C1=O)C)NC=N2.COC1=CC=CC=C1OCC(CO)O.
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