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Diethyl pyridine-2,4-dicarboxylate

Cat No.:V47575 Purity: ≥98%
Diethyl pyridine-2,4-dicarb is a potent prolyl 4-hydroxylase-directed pro-inhibitor.
Diethyl pyridine-2,4-dicarboxylate
Diethyl pyridine-2,4-dicarboxylate Chemical Structure CAS No.: 41438-38-4
Product category: New3
This product is for research use only, not for human use. We do not sell to patients.
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500mg
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Product Description
Diethyl pyridine-2,4-dicarb is a potent prolyl 4-hydroxylase-directed pro-inhibitor. Diethyl pyridine-2,4-dicarb inhibits proline hydroxylation and procollagen processing in chick embryo calvaria.
Diethyl pyridine-2,4-dicarboxylate (CAS 41438-38-4) is a potent prolyl 4-hydroxylase-directed proinhibitor. It is a heterocyclic organic compound with the chemical formula C₁₁H₁₃NO₄ and a molecular weight of 223.23. Diethyl pyridine-2,4-dicarboxylate inhibits prolyl hydroxylation and procollagen processing in chick-embryo calvaria.
Biological Activity I Assay Protocols (From Reference)
Targets
Diethyl pyridine-2,4-dicarboxylate targets prolyl 4-hydroxylase, a key enzyme involved in the hydroxylation of proline residues during collagen biosynthesis. By inhibiting this enzyme, the compound interferes with procollagen processing.
ln Vitro
In vitro, Diethyl pyridine-2,4-dicarboxylate is a potent prolyl 4-hydroxylase-directed proinhibitor. It inhibits prolyl hydroxylation and procollagen processing in chick-embryo calvaria. It is a pyridine derivative that has been extensively studied for its biological and pharmacological properties.
ln Vivo
In vivo data for Diethyl pyridine-2,4-dicarboxylate are limited in the available literature. As a prolyl 4-hydroxylase inhibitor, it may have potential for research in collagen-related disorders. Further in vivo studies are needed to evaluate its therapeutic potential.
Enzyme Assay
Diethyl pyridine-2,4-dicarboxylate's prolyl 4-hydroxylase inhibition activity can be characterized using biochemical assays. The compound's ability to inhibit prolyl hydroxylation can be assessed in chick-embryo calvaria or using purified enzyme preparations.
Cell Assay
In vitro cell experiments with Diethyl pyridine-2,4-dicarboxylate involve treating cells with the compound and assessing its effects on collagen synthesis and processing. The compound's effects on prolyl hydroxylation and procollagen processing are evaluated.
Animal Protocol
In vivo animal studies with Diethyl pyridine-2,4-dicarboxylate have been conducted using chick-embryo calvaria models. The compound's effects on bone development and collagen metabolism can be assessed. Further studies in mammalian models are needed.
ADME/Pharmacokinetics
Pharmacokinetic data for Diethyl pyridine-2,4-dicarboxylate are not available in the searched literature. As a small molecule with a molecular weight of 223.23, the compound may have reasonable bioavailability. Further pharmacokinetic studies are needed.
Toxicity/Toxicokinetics
Diethyl pyridine-2,4-dicarboxylate is considered safe for research use at typical concentrations. As a research compound, it is intended for laboratory use only and not for human consumption. Standard laboratory safety practices should be followed.
References

[1]. Inhibition of prolyl hydroxylation and procollagen processing in chick-embryo calvaria by a derivative of pyridine-2,4-dicarboxylate. Characterization of the diethyl ester as a proinhibitor. Biochem J. 1991 Apr 15;275 ( Pt 2)(Pt 2):469-7.

Additional Infomation
Diethyl pyridine-2,4-dicarboxylate is a potent prolyl 4-hydroxylase-directed proinhibitor. It inhibits prolyl hydroxylation and procollagen processing in chick-embryo calvaria. It has a molecular formula of C₁₁H₁₃NO₄ and a molecular weight of 223.23.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C11H13NO4
Molecular Weight
223.2252
Exact Mass
223.084
CAS #
41438-38-4
PubChem CID
170509
Appearance
Off-white to light yellow solid powder
Density
1.2±0.1 g/cm3
Boiling Point
330.9±22.0 °C at 760 mmHg
Flash Point
153.9±22.3 °C
Vapour Pressure
0.0±0.7 mmHg at 25°C
Index of Refraction
1.509
LogP
2
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
6
Heavy Atom Count
16
Complexity
254
Defined Atom Stereocenter Count
0
SMILES
CCOC(=O)C1=CC(=NC=C1)C(=O)OCC
InChi Key
MUUDQLHCIAOWPR-UHFFFAOYSA-N
InChi Code
InChI=1S/C11H13NO4/c1-3-15-10(13)8-5-6-12-9(7-8)11(14)16-4-2/h5-7H,3-4H2,1-2H3
Chemical Name
diethyl pyridine-2,4-dicarboxylate
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: ≥ 20 mg/mL (~89.6 mM)
Solubility (In Vivo)
Solubility in Formulation 1: ≥ 2.5 mg/mL (11.20 mM) (saturation unknown) in 10% DMSO + 40% PEG300 + 5% Tween-80 + 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 DMSO stock solution (25.0 mg/mL) to 400 μL of PEG300 and mix well; then add 50 μL of Tween-80 and mix well; finally add 450 μL of physiological saline and 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 (11.20 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 DMSO stock solution (25.0 mg/mL) to 900 μL of 20% SBE-β-CD saline and mix well.
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 3: ≥ 2.5 mg/mL (11.20 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 DMSO stock solution (25.0 mg/mL) to 900 μL of corn oil and mix well.

 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 4.4797 mL 22.3984 mL 44.7968 mL
5 mM 0.8959 mL 4.4797 mL 8.9594 mL
10 mM 0.4480 mL 2.2398 mL 4.4797 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.

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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?
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  • The answer of 17.513 mg appears in the Mass box. In a similar way, you may calculate the volume and concentration.

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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:
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  • The answer of 62.5 μL (0.1 ml) appears in the Volume (Start) box
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Note: Chemical formula is case sensitive: C12H18N3O4  c12h18n3o4
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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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