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Azido-PEG2-NHS ester

Cat No.:V12182 Purity: ≥97%
N3-PEG2-C2-NHS ester is a non-degradable linker containing 2 Polyethylene glycol (PEG) units, which may be utilized to prepare active Antibody-drug conjugates (ADC).
Azido-PEG2-NHS ester
Azido-PEG2-NHS ester Chemical Structure CAS No.: 1312309-64-0
Product category: New1
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
250mg
Other Sizes

Other Forms of Azido-PEG2-NHS ester:

  • Azido-PEG12-NHS ester
Official Supplier of:
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Purity & Quality Control Documentation

Purity: ≥97.00%

Product Description
N3-PEG2-C2-NHS ester is a non-degradable linker containing 2 Polyethylene glycol (PEG) units, which may be utilized to prepare active Antibody-drug conjugates (ADC). N3-PEG2-C2-NHS ester is a reagent for click chemistry. It has an Azide (N3) moiety and could undergo CuAAc (copper-catalyzed azide-alkyne cycloaddition reaction) with compounds bearing an Alkyne group. SPAAC (Strain-promoted alkyne-azide cycloaddition) may also happen with compounds bearing a BCN or DBCO group.
Azido-PEG2-NHS ester (CAS# 1312309-64-0) is a non-cleavable 2-unit PEG linker that can be used to synthesize antibody-drug conjugates (ADCs). It is a heterobifunctional crosslinker containing an azide group and an NHS ester. The hydrophilic PEG spacer increases solubility in aqueous media.
Biological Activity I Assay Protocols (From Reference)
Targets
Azido-PEG2-NHS ester is classified as an ADC linker and a click chemistry reagent. The NHS ester reacts with primary amines on proteins, peptides, and other amine-containing molecules. The azide group enables click chemistry reactions with alkyne-containing molecules.
ln Vitro
Azido-PEG2-NHS ester is used as a linker in the synthesis of antibody-drug conjugates (ADCs). It is not typically evaluated for direct biological activity as a standalone compound. Its role is to provide a PEG spacer and reactive groups for conjugation.
ln Vivo
Azido-PEG2-NHS ester is not typically evaluated for in vivo activity as a standalone compound. Its role is in the synthesis of ADCs, which are then evaluated in vivo. The PEG spacer can improve the pharmacokinetic properties of the conjugated molecules.
Enzyme Assay
Azido-PEG2-NHS ester is a chemical reagent, and its purity and identity are confirmed using analytical techniques such as NMR and HPLC. It is not typically used in enzyme or receptor binding assays. The NHS ester reactivity can be assessed by reacting it with amine-containing compounds.
Cell Assay
Azido-PEG2-NHS ester is not typically used in cell-based assays as a standalone compound. Its primary application is in the synthesis of ADCs, which are then tested in cell-based assays for their cytotoxicity and target specificity.
Animal Protocol
Azido-PEG2-NHS ester is not typically used in in vivo animal studies as a standalone compound. It is used to synthesize ADCs, which are then evaluated in animal models for their antitumor efficacy and safety.
ADME/Pharmacokinetics
Azido-PEG2-NHS ester has a molecular formula of C11H16N4O6 and a molecular weight of 300.27. It is a non-cleavable heterobifunctional crosslinker with a PEG2 spacer. It contains an azide group and an NHS ester.
Toxicity/Toxicokinetics
Specific toxicology data for Azido-PEG2-NHS ester are not detailed in the available literature. As a linker used in ADC synthesis, its toxicity is typically assessed as part of the final ADC product. Standard safety precautions should be taken when handling this compound.
Additional Infomation
Azido-PEG2-NHS ester is a non-cleavable PEG linker used in the synthesis of antibody-drug conjugates (ADCs). It is a click chemistry reagent containing an azide group, which can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAC) with alkyne-containing molecules. It is a research tool for the development of targeted cancer therapies.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C11H16N4O6
Molecular Weight
300.2679
Exact Mass
300.106
CAS #
1312309-64-0
Related CAS #
1108750-59-9
PubChem CID
59289487
Appearance
Colorless to light yellow liquid
LogP
-1.87
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
8
Rotatable Bond Count
11
Heavy Atom Count
21
Complexity
418
Defined Atom Stereocenter Count
0
SMILES
O(C(C([H])([H])C([H])([H])OC([H])([H])C([H])([H])OC([H])([H])C([H])([H])N=[N+]=[N-])=O)N1C(C([H])([H])C([H])([H])C1=O)=O
InChi Key
XDXWXTIRKQZRNN-UHFFFAOYSA-N
InChi Code
InChI=1S/C11H16N4O6/c12-14-13-4-6-20-8-7-19-5-3-11(18)21-15-9(16)1-2-10(15)17/h1-8H2
Chemical Name
(2,5-dioxopyrrolidin-1-yl) 3-[2-(2-azidoethoxy)ethoxy]propanoate
HS Tariff Code
2934.99.9001
Storage

Powder      -20°C    3 years

                     4°C     2 years

In solvent   -80°C    6 months

                  -20°C    1 month

Shipping Condition
Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs)
Solubility Data
Solubility (In Vitro)
DMSO : ~100 mg/mL (~333.03 mM)
Solubility (In Vivo)
Solubility in Formulation 1: ≥ 2.5 mg/mL (8.33 mM) (saturation unknown) in 10% DMSO + 40% PEG300 + 5% Tween80 + 45% Saline (add these co-solvents sequentially from left to right, and one by one), clear solution.
For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 400 μL PEG300 and mix evenly; then add 50 μL Tween-80 to the above solution and mix evenly; then add 450 μL normal saline to adjust the volume to 1 mL.
Preparation of saline: Dissolve 0.9 g of sodium chloride in 100 mL ddH₂ O to obtain a clear solution.

Solubility in Formulation 2: ≥ 2.5 mg/mL (8.33 mM) (saturation unknown) in 10% DMSO + 90% (20% SBE-β-CD in Saline) (add these co-solvents sequentially from left to right, and one by one), clear solution.
For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 900 μL of 20% SBE-β-CD physiological saline solution and mix evenly.
Preparation of 20% SBE-β-CD in Saline (4°C,1 week): Dissolve 2 g SBE-β-CD in 10 mL saline to obtain a clear solution.

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Solubility in Formulation 3: ≥ 2.5 mg/mL (8.33 mM) (saturation unknown) in 10% DMSO + 90% Corn Oil (add these co-solvents sequentially from left to right, and one by one), clear solution.
For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 900 μL of corn oil and mix evenly.


 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 3.3303 mL 16.6517 mL 33.3034 mL
5 mM 0.6661 mL 3.3303 mL 6.6607 mL
10 mM 0.3330 mL 1.6652 mL 3.3303 mL

*Note: Please select an appropriate solvent for the preparation of stock solution based on your experiment needs. For most products, DMSO can be used for preparing stock solutions (e.g. 5 mM, 10 mM, or 20 mM concentration); some products with high aqueous solubility may be dissolved in water directly. Solubility information is available at the above Solubility Data section. Once the stock solution is prepared, aliquot it to routine usage volumes and store at -20°C or -80°C. Avoid repeated freeze and thaw cycles.

Calculator

Molarity Calculator allows you to calculate the mass, volume, and/or concentration required for a solution, as detailed below:

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An example of molarity calculation using the molarity calculator is shown below:
What is the mass of compound required to make a 10 mM stock solution in 5 ml of DMSO given that the molecular weight of the compound is 350.26 g/mol?
  • Enter 350.26 in the Molecular Weight (MW) box
  • Enter 10 in the Concentration box and choose the correct unit (mM)
  • Enter 5 in the Volume box and choose the correct unit (mL)
  • Click the “Calculate” button
  • The answer of 17.513 mg appears in the Mass box. In a similar way, you may calculate the volume and concentration.

Dilution Calculator allows you to calculate how to dilute a stock solution of known concentrations. For example, you may Enter C1, C2 & V2 to calculate V1, as detailed below:

What volume of a given 10 mM stock solution is required to make 25 ml of a 25 μM solution?
Using the equation C1V1 = C2V2, where C1=10 mM, C2=25 μM, V2=25 ml and V1 is the unknown:
  • Enter 10 into the Concentration (Start) box and choose the correct unit (mM)
  • Enter 25 into the Concentration (End) box and select the correct unit (mM)
  • Enter 25 into the Volume (End) box and choose the correct unit (mL)
  • Click the “Calculate” button
  • The answer of 62.5 μL (0.1 ml) appears in the Volume (Start) box
g/mol

Molecular Weight Calculator allows you to calculate the molar mass and elemental composition of a compound, as detailed below:

Note: Chemical formula is case sensitive: C12H18N3O4  c12h18n3o4
Instructions to calculate molar mass (molecular weight) of a chemical compound:
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Definitions of molecular mass, molecular weight, molar mass and molar weight:
  • Molecular mass (or molecular weight) is the mass of one molecule of a substance and is expressed in the unified atomic mass units (u). (1 u is equal to 1/12 the mass of one atom of carbon-12)
  • Molar mass (molar weight) is the mass of one mole of a substance and is expressed in g/mol.
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Reconstitution Calculator allows you to calculate the volume of solvent required to reconstitute your vial.

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  • The answer appears in the Volume (to add to vial) box
In vivo Formulation Calculator (Clear solution)
Step 1: Enter information below (Recommended: An additional animal to make allowance for loss during the experiment)
Step 2: Enter in vivo formulation (This is only a calculator, not the exact formulation for a specific product. Please contact us first if there is no in vivo formulation in the solubility section.)
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Calculation results

Working concentration mg/mL;

Method for preparing DMSO stock solution mg drug pre-dissolved in μL DMSO (stock solution concentration mg/mL). Please contact us first if the concentration exceeds the DMSO solubility of the batch of drug.

Method for preparing in vivo formulation:Take μL DMSO stock solution, next add μL PEG300, mix and clarify, next addμL Tween 80, mix and clarify, next add μL ddH2O,mix and clarify.

(1) Please be sure that the solution is clear before the addition of next solvent. Dissolution methods like vortex, ultrasound or warming and heat may be used to aid dissolving.
             (2) Be sure to add the solvent(s) in order.

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