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Nadolol D9

Cat No.:V28684 Purity: ≥98%
Nadolol-d9 is a deuterium labelled form of Nadolol, a non-selective orally bioactive beta-adrenergic receptors blocker.
Nadolol D9
Nadolol D9 Chemical Structure CAS No.: 94513-92-5
Product category: New1
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
1mg
5mg
Other Sizes

Other Forms of Nadolol D9:

  • iso-Nadolol (tert-Butyl-d9)
  • Nadolol
Official Supplier of:
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Top Publications Citing lnvivochem Products
Product Description
Nadolol-d9 is a deuterium labelled form of Nadolol, a non-selective orally bioactive beta-adrenergic receptors blocker.
Nadolol D9 (CAS 94513-92-5) is the deuterium-labeled analogue of nadolol, a non-selective and orally active β-adrenergic receptor blocker. The deuterium labeling (nine deuterium atoms) allows the compound to be used as an internal standard for the quantification of nadolol in biological samples by mass spectrometry. Nadolol is used clinically for the treatment of hypertension and angina.
Biological Activity I Assay Protocols (From Reference)
Targets
Nadolol D9 targets β-adrenergic receptors, specifically acting as a non-selective β-blocker. As a labeled analogue, it retains the same pharmacological properties as the parent compound and is used as a tracer in pharmacokinetic and bioanalytical studies. It blocks the effects of catecholamines on β-receptors, reducing heart rate and blood pressure.
ln Vitro
In vitro activity of Nadolol D9 is not typically assessed separately from the parent compound, as it is primarily used as an analytical standard. The deuterium labeling does not significantly alter the compound's pharmacological activity, and its β-blocking effects are expected to be identical to those of unlabeled nadolol.
ln Vivo
In vivo activity of Nadolol D9 mirrors that of nadolol, which is a clinically effective non-selective β-blocker used for hypertension and angina. The deuterated analogue is used in pharmacokinetic studies to track the disposition of nadolol in vivo. Its pharmacological effects are mediated through β-adrenergic receptor blockade.
Enzyme Assay
In vitro enzyme/receptor binding assays for Nadolol D9 are not typically performed, as the compound is used as an analytical standard rather than as a pharmacological tool. For the parent compound nadolol, receptor binding assays involve measuring β-adrenergic receptor affinity using radioligand binding techniques. The deuterated analogue would be expected to show identical binding properties.
Cell Assay
In vitro cellular assays for Nadolol D9 are not typically performed, as the compound is used as an internal standard for LC-MS analysis. The parent compound nadolol is studied in cell-based assays to assess β-adrenergic receptor blockade. The deuterated analogue serves as a reference for quantifying nadolol concentrations in cellular samples.
Animal Protocol
In vivo animal experiments for Nadolol D9 are typically conducted as part of pharmacokinetic studies. The compound is administered to animals, and blood or tissue samples are collected at various time points. The deuterated compound is used as an internal standard for the quantification of nadolol levels by LC-MS, enabling accurate measurement of drug concentrations and pharmacokinetic parameters.
ADME/Pharmacokinetics
Nadolol D9 is used as an internal standard for the quantification of nadolol in pharmacokinetic studies by mass spectrometry. The deuterium labeling provides a mass shift that allows the labeled and unlabeled compounds to be distinguished during analysis. The compound has a molecular weight of 318.46 and molecular formula C₁₇H₁₈D₉NO₄. It should be stored appropriately.
Toxicity/Toxicokinetics
Toxicological data for Nadolol D9 are not separately reported, as it is a labeled analogue of nadolol. The safety profile of nadolol is well established from clinical use, with common adverse effects including bradycardia, fatigue, and dizziness. The deuterated analogue is used in research applications at very low concentrations as an analytical standard, posing minimal toxicity risk.
References

[1]. Nadolol for Treatment of Supraventricular Tachycardia in Infants and Young Children. Pediatr Cardiol. 2017 Mar;38(3):525-530.

Additional Infomation
Nadolol D9 is a deuterium-labeled analogue of nadolol with CAS number 94513-92-5, molecular formula C₁₇H₁₈D₉NO₄, and molecular weight 318.46. It is used as an internal standard for the quantification of nadolol in biological samples by LC-MS. Nadolol is a non-selective β-adrenergic receptor blocker. This product is for research use only.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C17H18D9NO4
Molecular Weight
318.456
Exact Mass
318.25
CAS #
94513-92-5
Related CAS #
Nadolol;42200-33-9
PubChem CID
76973216
Appearance
Off-white to light yellow solid powder
LogP
1.025
Hydrogen Bond Donor Count
4
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
6
Heavy Atom Count
22
Complexity
344
Defined Atom Stereocenter Count
0
SMILES
[2H]C([2H])([2H])C(C([2H])([2H])[2H])(C([2H])([2H])[2H])NCC(COC1=CC=CC2=C1CC(C(C2)O)O)O
InChi Key
VWPOSFSPZNDTMJ-GQALSZNTSA-N
InChi Code
InChI=1S/C17H27NO4/c1-17(2,3)18-9-12(19)10-22-16-6-4-5-11-7-14(20)15(21)8-13(11)16/h4-6,12,14-15,18-21H,7-10H2,1-3H3/i1D3,2D3,3D3
Chemical Name
5-[3-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]-2-hydroxypropoxy]-1,2,3,4-tetrahydronaphthalene-2,3-diol
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)
May dissolve in DMSO (in most cases), if not, try other solvents such as H2O, Ethanol, or DMF with a minute amount of products to avoid loss of samples
Solubility (In Vivo)
Note: Listed below are some common formulations that may be used to formulate products with low water solubility (e.g. < 1 mg/mL), you may test these formulations using a minute amount of products to avoid loss of samples.

Injection Formulations
(e.g. IP/IV/IM/SC)
Injection Formulation 1: DMSO : Tween 80: Saline = 10 : 5 : 85 (i.e. 100 μL DMSO stock solution 50 μL Tween 80 850 μL Saline)
*Preparation of saline: Dissolve 0.9 g of sodium chloride in 100 mL ddH ₂ O to obtain a clear solution.
Injection Formulation 2: DMSO : PEG300Tween 80 : Saline = 10 : 40 : 5 : 45 (i.e. 100 μL DMSO 400 μLPEG300 50 μL Tween 80 450 μL Saline)
Injection Formulation 3: DMSO : Corn oil = 10 : 90 (i.e. 100 μL DMSO 900 μL Corn oil)
Example: Take the Injection Formulation 3 (DMSO : Corn oil = 10 : 90) as an example, if 1 mL of 2.5 mg/mL working solution is to be prepared, you can take 100 μL 25 mg/mL DMSO stock solution and add to 900 μL corn oil, mix well to obtain a clear or suspension solution (2.5 mg/mL, ready for use in animals).
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Injection Formulation 4: DMSO : 20% SBE-β-CD in saline = 10 : 90 [i.e. 100 μL DMSO 900 μL (20% SBE-β-CD in saline)]
*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.
Injection Formulation 5: 2-Hydroxypropyl-β-cyclodextrin : Saline = 50 : 50 (i.e. 500 μL 2-Hydroxypropyl-β-cyclodextrin 500 μL Saline)
Injection Formulation 6: DMSO : PEG300 : castor oil : Saline = 5 : 10 : 20 : 65 (i.e. 50 μL DMSO 100 μLPEG300 200 μL castor oil 650 μL Saline)
Injection Formulation 7: Ethanol : Cremophor : Saline = 10: 10 : 80 (i.e. 100 μL Ethanol 100 μL Cremophor 800 μL Saline)
Injection Formulation 8: Dissolve in Cremophor/Ethanol (50 : 50), then diluted by Saline
Injection Formulation 9: EtOH : Corn oil = 10 : 90 (i.e. 100 μL EtOH 900 μL Corn oil)
Injection Formulation 10: EtOH : PEG300Tween 80 : Saline = 10 : 40 : 5 : 45 (i.e. 100 μL EtOH 400 μLPEG300 50 μL Tween 80 450 μL Saline)


Oral Formulations
Oral Formulation 1: Suspend in 0.5% CMC Na (carboxymethylcellulose sodium)
Oral Formulation 2: Suspend in 0.5% Carboxymethyl cellulose
Example: Take the Oral Formulation 1 (Suspend in 0.5% CMC Na) as an example, if 100 mL of 2.5 mg/mL working solution is to be prepared, you can first prepare 0.5% CMC Na solution by measuring 0.5 g CMC Na and dissolve it in 100 mL ddH2O to obtain a clear solution; then add 250 mg of the product to 100 mL 0.5% CMC Na solution, to make the suspension solution (2.5 mg/mL, ready for use in animals).
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Oral Formulation 3: Dissolved in PEG400
Oral Formulation 4: Suspend in 0.2% Carboxymethyl cellulose
Oral Formulation 5: Dissolve in 0.25% Tween 80 and 0.5% Carboxymethyl cellulose
Oral Formulation 6: Mixing with food powders


Note: Please be aware that the above formulations are for reference only. InvivoChem strongly recommends customers to read literature methods/protocols carefully before determining which formulation you should use for in vivo studies, as different compounds have different solubility properties and have to be formulated differently.

 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 3.1401 mL 15.7006 mL 31.4011 mL
5 mM 0.6280 mL 3.1401 mL 6.2802 mL
10 mM 0.3140 mL 1.5701 mL 3.1401 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.
/

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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