(2S,4R)-1-((S)-17-Amino-2-(tert-butyl)-4-oxo-6,9,12,15-tetraoxa-3-azaheptadecanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide - CAS 2010159-57-4

(2S,4R)-1-((S)-17-Amino-2-(tert-butyl)-4-oxo-6,9,12,15-tetraoxa-3-azaheptadecanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide - CAS 2010159-57-4 Catalog number: BADC-01566

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(2S,4R)-1-((S)-17-Amino-2-(tert-butyl)-4-oxo-6,9,12,15-tetraoxa-3-azaheptadecanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide is a linker widely used in antibody-drug conjugates (ADCs).

Category
ADCs Linker
Product Name
(2S,4R)-1-((S)-17-Amino-2-(tert-butyl)-4-oxo-6,9,12,15-tetraoxa-3-azaheptadecanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide
CAS
2010159-57-4
Catalog Number
BADC-01566
Molecular Formula
C32H49N5O8S
Molecular Weight
663.83
Purity
97%
(2S,4R)-1-((S)-17-Amino-2-(tert-butyl)-4-oxo-6,9,12,15-tetraoxa-3-azaheptadecanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide

Ordering Information

Catalog Number Size Price Quantity
BADC-01566 -- $-- Inquiry
Description
(2S,4R)-1-((S)-17-Amino-2-(tert-butyl)-4-oxo-6,9,12,15-tetraoxa-3-azaheptadecanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide is a linker widely used in antibody-drug conjugates (ADCs).
Synonyms
(S,R,S)-AHPC-PEG4-NH2
IUPAC Name
(2S,4R)-1-[(2S)-2-[[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]acetyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]pyrrolidine-2-carboxamide
Canonical SMILES
CC1=C(SC=N1)C2=CC=C(C=C2)CNC(=O)C3CC(CN3C(=O)C(C(C)(C)C)NC(=O)COCCOCCOCCOCCN)O
InChI
InChI=1S/C32H49N5O8S/c1-22-28(46-21-35-22)24-7-5-23(6-8-24)18-34-30(40)26-17-25(38)19-37(26)31(41)29(32(2,3)4)36-27(39)20-45-16-15-44-14-13-43-12-11-42-10-9-33/h5-8,21,25-26,29,38H,9-20,33H2,1-4H3,(H,34,40)(H,36,39)/t25-,26+,29-/m1/s1
InChIKey
VSMWDQCRYIOFMX-UWPQIUOOSA-N
Solubility
10 mM in DMSO
Shipping
Room temperature in continental US; may vary elsewhere
Storage
Powder
-20°C
3 years



4°C
2 years


In solvent
-80°C
6 months



-20°C
1 month
Pictograms
Harmful
Signal Word
Warning

(2S,4R)-1-((S)-17-Amino-2-(tert-butyl)-4-oxo-691215-tetraoxa-3-azaheptadecanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide is a complex chemical compound with potential applications in various fields. Here are some key applications of this compound:

Drug Development: This compound can be investigated as a potential pharmaceutical agent due to its unique structural features. It may interact with specific biological pathways, making it a candidate for targeted therapy in diseases such as cancer or autoimmune disorders. Researchers can leverage its structure to design derivatives with enhanced efficacy and reduced side effects.

Biochemical Research: The compound can serve as a tool in studying biochemical pathways and protein interactions. Its unique structure allows it to act as a molecular probe, helping scientists understand the intricate details of biological processes at the molecular level. This knowledge can pave the way for discovering new drug targets or regulatory mechanisms.

Enzyme Inhibition Studies: Given its complex structure, the compound may function as an enzyme inhibitor, providing insights into enzyme regulation and potential therapeutic applications. By investigating its inhibitory effects, researchers can identify critical points of enzymatic control in various metabolic pathways. This can lead to the development of new strategies for managing metabolic diseases or infections.

Chemical Biology: The compound can be used in chemical biology to study the interactions between small molecules and biological systems. Its detailed molecular configuration makes it ideal for developing chemical probes to investigate cellular processes and signaling pathways. These studies are crucial for understanding drug actions and developing new therapeutic agents.

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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