Account N-(2-Acetylphenyl)-2-(8-bromo-7-(but-2-yn-1-yl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)acetamide
- Catalog No. :
- ACXSIV257
- CAS No. :
- 2279114-31-5
- Molecular Formula :
- C20H18BrN5O4
- Molecular Weight :
- 472.30
IUPAC Name:N-(2-acetylphenyl)-2-(8-bromo-7-(but-2-yn-1-yl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)acetamide
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50mg95%$125.00Login to see priceIn stockInquiry
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Product Information
| Product Name | N-(2-Acetylphenyl)-2-(8-bromo-7-(but-2-yn-1-yl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)acetamide |
|---|---|
| IUPAC Name | N-(2-acetylphenyl)-2-(8-bromo-7-(but-2-yn-1-yl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)acetamide |
| Molecular Formula | C20H18BrN5O4 |
| Molecular Weight | 472.30 |
| SMILES | O=C(NC1=CC=CC=C1C(C)=O)CN2C(N(C)C3=C(N(CC#CC)C(Br)=N3)C2=O)=O |
| InChI Key | RKFOIPYKBLOUTN-UHFFFAOYSA-N |
| Synonym | Linagliptin impurity KH-2;N-(2-Acetylphenyl)-2-(8-bromo-7-(but-2-yn-1-yl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)acetamide (Linagliptin Impurity);1H-Purine-1-acetamide, N-(2-acetylphenyl)-8-bromo-7-(2-butyn-1-yl)-2,3,6,7-tetrahydro-3-methyl-2,6-dioxo- |
| CAS No. | 2279114-31-5 |
Synthetic Route by SureRoute
2. ACXSIV257 Molecular Building Block Synthetic Route
-
(R)-N-(2-acetylphenyl)-2-(8-(3-aminopiperidin-1-yl)-7-(but-2-yn-1-yl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)acetamide hydrochloride
(R)-tert-Butyl (1-(1-(2-((2-acetylphenyl)amino)-2-oxoethyl)-7-(but-2-yn-1-yl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperidin-3-yl)carbamate (Linagliptin Impurity)