Linagliptin Acetamide
Product Code
TRC-L465920
CAS Number
Product Format
Neat
Molecular Formula
C27 H30 N8 O3
Molecular Weight
514.58
API Family
LinagliptinProduct Categories
Product Type
ImpurityAlternate CAS Number
Purity
>95% (HPLC)
Documentation
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Product Information
Chemical Data
Analyte Name
Linagliptin Acetamide
CAS Number
1803079-49-3
Molecular Formula
C27 H30 N8 O3
Molecular Weight
514.58
Accurate Mass
514.2441
SMILES
CC#CCn1c(nc2N(C)C(=O)N(Cc3nc(C)c4ccccc4n3)C(=O)c12)N5CCC[C@H](C5)NC(=O)C
InChI
InChI=1S/C27H30N8O3/c1-5-6-14-34-23-24(31-26(34)33-13-9-10-19(15-33)29-18(3)36)32(4)27(38)35(25(23)37)16-22-28-17(2)20-11-7-8-12-21(20)30-22/h7-8,11-12,19H,9-10,13-16H2,1-4H3,(H,29,36)/t19-/m1/s1
IUPAC
N-[(3R)-1-[7-but-2-ynyl-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]-2,6-dioxopurin-8-yl]piperidin-3-yl]acetamide
Alternate CAS Number
Radioisotope labelled: 1297274-00-0
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Impurity
Product Format
Neat
API Family
Purity
>95% (HPLC)