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RO495

Cat No.:V41678 Purity: ≥98%
RO495 is a potent inhibitor of non-receptor tyrosine protein kinase 2 (TYK2 kinase).
RO495
RO495 Chemical Structure CAS No.: 1258296-60-4
Product category: New3
This product is for research use only, not for human use. We do not sell to patients.
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Product Description
RO495 is a potent inhibitor of non-receptor tyrosine protein kinase 2 (TYK2 kinase).
RO495 (CS-2667) is a potent inhibitor of non-receptor tyrosine protein kinase 2 (TYK2 kinase). It has a molecular weight of 389.24 g/mol, a formula of C17H14Cl2N6O, and a CAS number of 1258296-60-4. RO495 is a research compound for studying TYK2 function in immune signaling.
Biological Activity I Assay Protocols (From Reference)
Targets
RO495 targets TYK2 (non-receptor tyrosine-protein kinase 2). It acts as a potent inhibitor of TYK2 kinase activity. The compound inhibits TYK2 with an IC50 of 1.5 nM as tested in cell-based assays.
ln Vitro
In vitro, RO495 is a potent inhibitor of TYK2 with an IC50 of 1.5 nM as tested in cell-based assays. It is a research compound for studying TYK2 function. Specific cellular activity data are not detailed in the available sources.
ln Vivo
In vivo activity data for RO495 are not extensively detailed in the available sources. The compound is a research tool for studying TYK2 function in immune signaling. Specific in vivo efficacy data in animal models have not been reported.
Enzyme Assay
The in vitro enzyme assay for RO495 involves measuring the inhibition of TYK2 kinase activity. Recombinant TYK2 is incubated with a substrate peptide and ATP in the presence of varying compound concentrations. The IC50 value (1.5 nM) is determined by quantifying the reduction in substrate phosphorylation using techniques such as radioactive or fluorescence-based assays.
Cell Assay
Cellular assays for RO495 are performed using cell lines treated with the compound at varying concentrations. TYK2 phosphorylation and downstream signaling are assessed by Western blotting using phospho-specific antibodies.
Animal Protocol
In vivo animal studies for RO495 are not detailed in the available sources. The compound is a research tool for studying TYK2 function. Specific animal models, dosing regimens, and efficacy data have not been reported.
ADME/Pharmacokinetics
Pharmacokinetic data for RO495 are not available in the provided sources. The compound has a molecular weight of 389.24 g/mol. Powder formulations should be stored at -20°C for long-term storage or at 0-4°C for short-term storage.
Toxicity/Toxicokinetics
Toxicity data for RO495 are not reported in the available sources. As a research compound, it is not intended for therapeutic use. Specific toxicological profiles have not been characterized.
References

[1]. A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein. Molecular Pharmacology November 2019, 96 (5) 629-640.

Additional Infomation
RO495 is a research compound for studying TYK2 function in immune signaling. It is a potent TYK2 inhibitor with an IC50 of 1.5 nM in cell-based assays. The compound is available from commercial suppliers for research use only.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C17H14CL2N6O
Molecular Weight
389.2387
Exact Mass
388.06
CAS #
1258296-60-4
PubChem CID
57519505
Appearance
Light yellow to yellow solid powder
Density
1.5±0.1 g/cm3
Index of Refraction
1.739
LogP
4.36
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
6
Rotatable Bond Count
4
Heavy Atom Count
26
Complexity
474
Defined Atom Stereocenter Count
0
SMILES
CC1=CC(=NC(=N1)N)NC2=NC=CC(=C2)NC(=O)C3=C(C=CC=C3Cl)Cl
InChi Key
LNGDQKGREFSTHB-UHFFFAOYSA-N
InChi Code
InChI=1S/C17H14Cl2N6O/c1-9-7-14(25-17(20)22-9)24-13-8-10(5-6-21-13)23-16(26)15-11(18)3-2-4-12(15)19/h2-8H,1H3,(H4,20,21,22,23,24,25,26)
Chemical Name
N-[2-[(2-amino-6-methylpyrimidin-4-yl)amino]pyridin-4-yl]-2,6-dichlorobenzamide
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 (~256.91 mM)
Solubility (In Vivo)
Solubility in Formulation 1: ≥ 2.5 mg/mL (6.42 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 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.

 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 2.5691 mL 12.8455 mL 25.6911 mL
5 mM 0.5138 mL 2.5691 mL 5.1382 mL
10 mM 0.2569 mL 1.2846 mL 2.5691 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:
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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.

  • 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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