![propan-2-yl [(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]acetate structure](/static/products/877/877778-89-7.png)
propan-2-yl [(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]acetate
propan-2-yl 2-(1-benzylpyrazolo[5,4-d]pyrimidin-4-yl)sulfanylacetate
Also Known As: isopropyl 2-((1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)thio)acetate|propan-2-yl [(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]acetate|propan-2-yl 2-(1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetate
CAS: 877778-89-7
| Molecular Formula | C17H18N4O2S |
|---|---|
| Molecular Weight | 342.11505 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 342.11505 |
| Monoisotopic Mass | 342.11505 |
| Heavy Atoms | 24 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 877778-89-7 |
|---|---|
| SMILES | CC(C)OC(=O)CSC1=NC=NC2=C1C=NN2CC3=CC=CC=C3 |
| InChIKey | FKHQYZGGSQNOKA-UHFFFAOYSA-N |
Product Overview
propan-2-yl [(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]acetate (CAS 877778-89-7), with molecular formula C17H18N4O2S and molecular weight 342.11505 g/mol. IUPAC: propan-2-yl 2-(1-benzylpyrazolo[5,4-d]pyrimidin-4-yl)sulfanylacetate.
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.
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propan-2-yl [(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]acetate is a custom synthesis product. We offer services from milligram to kilogram scale.
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