Account (R)-2-((1-(7-(But-2-yn-1-yl)-3-methyl-1-((4-methylquinazolin-2-yl)methyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperidin-3-yl)carbamoyl)benzoic acid
- Catalog No. :
- ACBZFG541
- CAS No. :
- 2074688-81-4
- Molecular Formula :
- C33H32N8O5
- Molecular Weight :
- 620.67
IUPAC Name:(R)-2-((1-(7-(but-2-yn-1-yl)-3-methyl-1-((4-methylquinazolin-2-yl)methyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperidin-3-yl)carbamoyl)benzoic acid
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Product Information
| Product Name | (R)-2-((1-(7-(But-2-yn-1-yl)-3-methyl-1-((4-methylquinazolin-2-yl)methyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperidin-3-yl)carbamoyl)benzoic acid |
|---|---|
| IUPAC Name | (R)-2-((1-(7-(but-2-yn-1-yl)-3-methyl-1-((4-methylquinazolin-2-yl)methyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperidin-3-yl)carbamoyl)benzoic acid |
| Molecular Formula | C33H32N8O5 |
| Molecular Weight | 620.67 |
| SMILES | O=C(O)C1=CC=CC=C1C(N[C@H]2CN(C(N3CC#CC)=NC(N(C)C(N4CC5=NC(C)=C6C=CC=CC6=N5)=O)=C3C4=O)CCC2)=O |
| InChI Key | JMZNITUCXDATHF-OAQYLSRUSA-N |
| Synonym | Linagliptin Impurity 30;Benzoic acid, 2-[[[(3R)-1-[7-(2-butyn-1-yl)-2,3,6,7-tetrahydro-3-methyl-1-[(4-methyl-2-quinazolinyl)methyl]-2,6-dioxo-1H-purin-8-yl]-3-piperidinyl]amino]carbonyl]-;yl-1-[(4-methylquinazolin-2-yl)methyl]-2,6-dioxopurin-8-yl]piperidin-3-yl]carbamoyl]benzoic acid;Linagliptin Impurity 104 |
| CAS No. | 2074688-81-4 |
Synthetic Route by SureRoute
2. ACBZFG541 Molecular Building Block Synthetic Route
methyl (R)-2-((1-(7-(but-2-yn-1-yl)-3-methyl-1-((4-methylquinazolin-2-yl)methyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperidin-3-yl)carbamoyl)benzoate
N1,N2-Bis((R)-1-(7-(but-2-yn-1-yl)-3-methyl-1-((4-methylquinazolin-2-yl)methyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperidin-3-yl)phthalamide
rel-2-((R)-3-Aminopiperidine-1-carbonyl)-N-((R)-1-(7-(but-2-yn-1-yl)-3-methyl-1-((4-methylquinazolin-2-yl)methyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperidin-3-yl)benzamide