CAS 668273-75-4

1,1-Dimethylethyl N-[(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]carbamate

Description:

1,1-Dimethylethyl N-[(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]carbamate, with CAS number 668273-75-4, is a complex organic compound characterized by its intricate molecular structure, which includes multiple functional groups such as carbamate and piperidine. This compound is notable for its potential biological activity, often explored in pharmaceutical research for its interactions with specific biological targets. The presence of a quinazoline moiety suggests possible applications in medicinal chemistry, particularly in the development of therapeutic agents. Its structure indicates a degree of lipophilicity, which may influence its pharmacokinetic properties, including absorption and distribution in biological systems. Additionally, the compound's stereochemistry, particularly the (3R) configuration, may play a crucial role in its biological efficacy and specificity. Overall, this substance exemplifies the complexity and diversity of modern synthetic organic compounds used in drug discovery and development.

Formula: C₃₀H₃₆N₈O₄

InChI: InChI=1S/C30H36N8O4/c1-7-8-16-37-24-25(34-27(37)36-15-11-12-20(17-36)32-28(40)42-30(3,4)5)35(6)29(41)38(26(24)39)18-23-31-19(2)21-13-9-10-14-22(21)33-23/h9-10,13-14,20H,11-12,15-18H2,1-6H3,(H,32,40)/t20-/m1/s1

InChI key: InChIKey=PQEIZFATTRGTNW-HXUWFJFHSA-N

SMILES: C(C#CC)N1C2=C(N=C1N3C[C@H](NC(OC(C)(C)C)=O)CCC3)N(C)C(=O)N(CC4=NC5=C(C(C)=N4)C=CC=C5)C2=O

Synonyms:

• 1,1-Dimethylethyl N-[(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]carbamate
• Boc-Linagliptin
• Carbamic acid, N-[(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]-, 1,1-dimethylethyl ester
• Carbamic acid, [(3R)-1-[7-(2-butynyl)-2,3,6,7-tetrahydro-3-methyl-1-[(4-methyl-2-quinazolinyl)methyl]-2,6-dioxo-1H-purin-8-yl]-3-piperidinyl]-, 1,1-dimethylethyl ester

Tert-butyl((3s)-1-(7-(but-2-yn-1-yl)-3-Methyl-1-((4-Methylquinazolin-2-yl)Methyl)-2,6-dioxo-2,3,4,5,6,7-hexahydro-1h-purin-8-yl)piperidin-3-yl)carbaMate

CAS: 668273-75-4

Formula: C₃₀H₃₆N₈O₄

Purity: 97%

Color and Shape: Solid

Molecular weight: 572.6580

Ref: IN-DA00FGWC

Linagliptin Impurity 43

CAS: 668273-75-4

Formula: C₃₀H₃₆N₈O₄

Color and Shape: White To Off-White Solid

Molecular weight: 572.67

Ref: 4Z-L-4437

(R)-tert-Butyl (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)carbamate

CAS: 668273-75-4

(R)-tert-Butyl (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)carbamate

Purity: 97%

Molecular weight: 572.67g/mol

Ref: 54-OR1065370

Linagliptin Related Compound B

CAS: 668273-75-4

Formula: C₃₀H₃₆N₈O₄

Molecular weight: 572.66

Ref: ST-EA-CP-L1002

N-Boc Linagliptin

Controlled Product

CAS: 668273-75-4

Applications N-Boc Linagliptin is an impurity of linagliptin (L465900), which is a novel potent and selective dipeptidyl peptidase-4 (DPP-4) inhibitor with potential use in the treatment of type 2 diabetes.
References Prabavathy, N. et al.: Int. J. Pharm. Bio. Sci., 2, 438 (2011); Deacon, C.F.: Diab. Obes. Metab., 13, 7 (2011);

Formula: C₃₀H₃₆N₈O₄

Color and Shape: Neat

Molecular weight: 572.66

Ref: TR-B656810

N-Boc Linagliptin

CAS: 668273-75-4

N-Boc Linagliptin is a drug product that is an analytical standard. It is a synthetic, impurity free API with high purity and pharmacopoeia grade. The CAS No. 668273-75-4 denotes this compound as an N-Boc protected form of Linagliptin. This compound has been developed for its potential use in the treatment of type 2 diabetes mellitus, obesity and related disorders.

Formula: C₃₀H₃₆N₈O₄

Purity: Min. 95%

Molecular weight: 572.66 g/mol

Ref: 3D-TBB27375

(R)-tert-Butyl (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)carbamate

CAS: 668273-75-4

(R)-tert-Butyl (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)carbamate is a useful organic compound for research related to life sciences and the catalog number is T67221.

Formula: C₃₀H₃₆N₈O₄

Color and Shape: Solid

Molecular weight: 572.66

Ref: TM-T67221