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3-Hydroxy-4-aminopyridine

Alias: 3Hydroxy4aminopyridine; 3 Hydroxy 4 aminopyridine
Cat No.:V38508 Purity: ≥98%
3-Hydroxy-4-aminopyridine is an endogenously produced metabolite.
3-Hydroxy-4-aminopyridine
3-Hydroxy-4-aminopyridine Chemical Structure CAS No.: 52334-53-9
Product category: New2
This product is for research use only, not for human use. We do not sell to patients.
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Product Description
3-Hydroxy-4-aminopyridine is an endogenously produced metabolite.
3-Hydroxy-4-aminopyridine (CAS#: 52334-53-9) is an aminopyridine with the molecular formula C5H6N2O and a molecular weight of 110.11. It is also known as 4-aminopyridin-3-ol. This compound is an endogenous metabolite and is a hydroxylated impurity as well as a metabolite of the potassium channel blocker Fampridine (4-aminopyridine). It appears as a solid powder.
Biological Activity I Assay Protocols (From Reference)
Targets
3-Hydroxy-4-aminopyridine does not have a well-defined pharmacological target, as it is primarily an endogenous metabolite and impurity. It is a metabolite of the potassium channel blocker Fampridine. The compound may interact with various enzymes and receptors, but its specific binding targets have not been fully characterized. It is not used as a therapeutic agent.
ln Vitro
3-Hydroxy-4-aminopyridine does not possess significant pharmacological activity as a pure compound in typical in vitro assays, as it is primarily an endogenous metabolite. Studies may involve measuring its presence as a metabolite of Fampridine or as an impurity in pharmaceutical preparations. The compound is used as a reference standard in analytical chemistry. It is not studied for specific biological activities.
ln Vivo
In vivo activity of 3-Hydroxy-4-aminopyridine is related to its role as a metabolite of the potassium channel blocker Fampridine. It is formed in the body through the metabolism of Fampridine. However, the compound itself is not used therapeutically, and comprehensive in vivo studies evaluating its pharmacokinetic properties, efficacy, and safety are limited. Its toxicity profile is primarily related to its role as a metabolite and impurity.
Enzyme Assay
In vitro enzyme/receptor binding experiments for 3-Hydroxy-4-aminopyridine are not typical, as it is a metabolite rather than a pharmacologically active compound. Studies may involve measuring its presence as a metabolite of Fampridine or as an impurity in pharmaceutical preparations. Its chemical properties are characterized using standard analytical methods such as HPLC and mass spectrometry. The compound is also used as a reference standard in analytical chemistry.
Cell Assay
In vitro cellular experiments for 3-Hydroxy-4-aminopyridine are not typical, as it is a metabolite rather than a pharmacologically active compound. The compound may be used in studies to evaluate its cytotoxicity or its metabolism in cell lines. However, comprehensive in vitro cellular studies are limited. The compound's aminopyridine structure may interact with cellular targets, but its activity is not well characterized.
Animal Protocol
In vivo animal experiments for 3-Hydroxy-4-aminopyridine are not typical, as it is a metabolite rather than a drug candidate. Studies may involve administering Fampridine to animals and measuring the levels of 3-Hydroxy-4-aminopyridine as a metabolite. However, comprehensive in vivo studies evaluating its pharmacokinetic properties are limited.
ADME/Pharmacokinetics
Metabolism / Metabolites
Known metabolites of 3-hydroxy-4-aminopyridine include 4-amino-3-hydroxypyridine sulfate.
Pharmacokinetic properties of 3-Hydroxy-4-aminopyridine are related to its role as a metabolite of Fampridine. It is formed in the body through the metabolism of Fampridine. The compound's physicochemical properties, such as molecular weight (110.11) and solubility, are typical of aminopyridines. Detailed pharmacokinetic studies are limited.
Toxicity/Toxicokinetics
Toxicological data for 3-Hydroxy-4-aminopyridine are limited. As a metabolite and impurity, it may have toxicological implications, but comprehensive toxicology studies have not been extensively reported. Standard safety precautions for handling aminopyridines apply, including the use of personal protective equipment and working in a well-ventilated area. The toxicological properties of this substance have not been fully investigated.
Additional Infomation
3-Hydroxy-4-aminopyridine is an aminopyridine.
3-Hydroxy-4-aminopyridine is a research compound that has not entered clinical trials or received regulatory approval for therapeutic use. It is primarily used as a reference standard in analytical chemistry and as a metabolite of the potassium channel blocker Fampridine. The compound is an endogenous metabolite and is also known as 4-aminopyridin-3-ol. Further research is needed to explore its potential biological activities.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C₅H₆N₂O
Molecular Weight
110.11
Exact Mass
110.048
CAS #
52334-53-9
PubChem CID
2762419
Appearance
White to light brown solid powder
Density
1.3±0.1 g/cm3
Boiling Point
447.4±30.0 °C at 760 mmHg
Melting Point
222-223ºC
Flash Point
224.4±24.6 °C
Vapour Pressure
0.0±1.1 mmHg at 25°C
Index of Refraction
1.651
LogP
0.41
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
0
Heavy Atom Count
8
Complexity
76.8
Defined Atom Stereocenter Count
0
InChi Key
DBDKLFOUWUHPDW-UHFFFAOYSA-N
InChi Code
InChI=1S/C5H6N2O/c6-4-1-2-7-3-5(4)8/h1-3,8H,(H2,6,7)
Chemical Name
4-aminopyridin-3-ol
Synonyms
3Hydroxy4aminopyridine; 3 Hydroxy 4 aminopyridine
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

Note: This product requires protection from light (avoid light exposure) during transportation and storage.
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 : ~16.67 mg/mL (~151.39 mM)
Solubility (In Vivo)
Solubility in Formulation 1: ≥ 2.08 mg/mL (18.89 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 20.8 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.

Solubility in Formulation 2: ≥ 2.08 mg/mL (18.89 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 20.8 mg/mL clear DMSO stock solution to 900 μL of corn oil and mix evenly.

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Solubility in Formulation 3: ≥ 1.67 mg/mL (15.17 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 16.7 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.


 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 9.0818 mL 45.4091 mL 90.8183 mL
5 mM 1.8164 mL 9.0818 mL 18.1637 mL
10 mM 0.9082 mL 4.5409 mL 9.0818 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:

  • Calculate the Mass of a compound required to prepare a solution of known volume and concentration
  • Calculate the Volume of solution required to dissolve a compound of known mass to a desired concentration
  • Calculate the Concentration of a solution resulting from a known mass of compound in a specific volume
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:
  • To calculate molar mass of a chemical compound, please enter the chemical/molecular formula and click the “Calculate’ button.
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.

  • Enter the mass of the reagent and the desired reconstitution concentration as well as the correct units
  • Click the “Calculate” button
  • 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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