NSC268235
2-(hydroxymethyl)-5-(4-prop-2-enylsulfanylpyrazolo[5,4-d]pyrimidin-1-yl)oxolane-3,4-diol
Also Known As: 2-(hydroxymethyl)-5-(4-prop-2-enylsulfanylpyrazolo[3,4-d]pyrimidin-1-yl)oxolane-3,4-diol|1-Pentofuranosyl-4-[(prop-2-en-1-yl)sulfanyl]-1H-pyrazolo[3,4-d]pyrimidine
CAS: 64372-72-1
| Molecular Formula | C13H16N4O4S |
|---|---|
| Molecular Weight | 324.08923 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.08923 |
| Monoisotopic Mass | 324.08923 |
| Heavy Atoms | 22 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 64372-72-1 |
|---|---|
| SMILES | C=CCSC1=NC=NC2=C1C=NN2C3C(C(C(O3)CO)O)O |
| InChIKey | JXDXCRYUAAMGGP-UHFFFAOYSA-N |
Product Overview
NSC268235 (CAS 64372-72-1), with molecular formula C13H16N4O4S and molecular weight 324.08923 g/mol. IUPAC: 2-(hydroxymethyl)-5-(4-prop-2-enylsulfanylpyrazolo[5,4-d]pyrimidin-1-yl)oxolane-3,4-diol.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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