Account (2S,3S,4S,5R,6R)-6-((6-Amino-2-(5-fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)-5-((methoxycarbonyl)amino)pyrimidin-4-yl)amino)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
- Catalog No. :
- ACFCFX582
- CAS No. :
- 2112745-90-9
- Molecular Formula :
- C25H24F2N8O8
- Molecular Weight :
- 602.51
IUPAC Name:(2S,3S,4S,5R,6R)-6-((6-amino-2-(5-fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)-5-((methoxycarbonyl)amino)pyrimidin-4-yl)amino)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
![(2S,3S,4S,5R,6R)-6-((6-Amino-2-(5-fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)-5-((methoxycarbonyl)amino)pyrimidin-4-yl)amino)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (2S,3S,4S,5R,6R)-6-((6-Amino-2-(5-fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)-5-((methoxycarbonyl)amino)pyrimidin-4-yl)amino)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid |
|---|---|
| IUPAC Name | (2S,3S,4S,5R,6R)-6-((6-amino-2-(5-fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)-5-((methoxycarbonyl)amino)pyrimidin-4-yl)amino)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid |
| Molecular Formula | C25H24F2N8O8 |
| Molecular Weight | 602.51 |
| SMILES | FC1=CN=C(N(N=C2C3=NC(N)=C(NC(OC)=O)C(N[C@@H]4O[C@@H]([C@H]([C@@H]([C@H]4O)O)O)C(O)=O)=N3)CC5=C(C=CC=C5)F)C2=C1 |
| InChI Key | XSKBSPAQDCWGKC-YGBCKFAYSA-N |
| Synonym | 1-[[6-Amino-2-[5-fluoro-1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-[(methoxycarbonyl)amino]-4-pyrimidinyl]amino]-1-deoxy-β-D-glucopyranuronic acid;(2S,3S,4S,5R,6R)-6-((6-amino-2-(5-fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)-5-((methoxycarbonyl)amino)pyrimidin-4-yl)amino)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid;Butenafine Impurity 72;Vericiguat gluconide |
| CAS No. | 2112745-90-9 |
Synthetic Route by SureRoute
2. ACFCFX582 Molecular Building Block Synthetic Route
Methyl (4,6-diamino-2-(5-fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)pyrimidin-5-yl)carbamate
isopropyl (4,6-diamino-2-(1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)pyrimidin-5-yl)(methyl)carbamate
methyl (4,6-diamino-2-(1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)pyrimidin-5-yl)(ethyl)carbamate