AC1Q66GC
[3,4-diacetyloxy-5-(7-chloro-2H-pyrazolo[4,3-d]pyrimidin-3-yl)oxolan-2-yl]methyl acetate
Also Known As: 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol|[3,4-diacetyloxy-5-(7-chloro-2H-pyrazolo[4,3-d]pyrimidin-3-yl)oxolan-2-yl]methyl acetate|2,3,5-Tri-O-acetyl-1,4-anhydro-1-(7-chloro-1H-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol|[3,4-diacetoxy-5-(7-chloro-1H-pyrazolo[4,3-d]pyrimidin-3-yl)tetrahydrofuran-2-yl]methyl acetate
| Molecular Formula | C16H17ClN4O7 |
|---|---|
| Molecular Weight | 412.07858 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 143.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 412.07858 |
| Monoisotopic Mass | 412.07858 |
| Heavy Atoms | 28 |
| Complexity | 624.0 |
Chemical Identifiers
| CAS Number | 33822-98-9 |
|---|---|
| SMILES | CC(=O)OCC1C(C(C(O1)C2=C3C(=NN2)C(=NC=N3)Cl)OC(=O)C)OC(=O)C |
| InChIKey | UFBRJTPMMKAJHM-UHFFFAOYSA-N |
Product Overview
AC1Q66GC (CAS 33822-98-9), with molecular formula C16H17ClN4O7 and molecular weight 412.07858 g/mol. IUPAC: [3,4-diacetyloxy-5-(7-chloro-2H-pyrazolo[4,3-d]pyrimidin-3-yl)oxolan-2-yl]methyl acetate.
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