| Size | Price | Stock | Qty |
|---|---|---|---|
| 5mg |
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| 10mg |
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| 25mg |
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| 50mg |
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| Other Sizes |
| Targets |
Histamine H1 Receptor (indirectly, as an impurity standard).
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|---|---|
| ln Vitro |
No in vitro activity data are reported for Deschloro Cetirizine as a pure compound. It is presumed to have lower potency at the H1 receptor compared to Cetirizine due to the removal of the chloro group.
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| ln Vivo |
Not applicable, as it is not intended for in vivo efficacy studies. As an impurity, it is not used in animal models for therapeutic assessment.
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| Enzyme Assay |
For cell-free impurity analysis by HPLC: Deschloro Cetirizine diHCl reference standard is dissolved in mobile phase (e.g., phosphate buffer/acetonitrile) at 0.1-1 mg/mL. The solution is injected into an HPLC system equipped with a C18 column (e.g., 250×4.6 mm, 5 um). UV detection is performed at 230 nm. The retention time is compared to Cetirizine peak for impurity identification and quantitation.
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| Cell Assay |
No cell-based assays are performed. The compound is an analytical standard, not intended for biological evaluation.
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| Animal Protocol |
No animal studies are conducted. Deschloro Cetirizine is used for analytical quality control of Cetirizine drug products, not for in vivo experimentation.
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| ADME/Pharmacokinetics |
PK properties are not reported for Deschloro Cetirizine. As a dechlorinated analog of Cetirizine, it is expected to have similar but not identical pharmacokinetic properties: oral absorption likely preserved, moderate plasma protein binding (~90%), and renal excretion of unchanged drug.
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| Toxicity/Toxicokinetics |
Not applicable. As a pharmaceutical impurity, it is not administered as a drug. Safety profile is not established. Cetirizine has a well-established safety profile with mild CNS effects (somnolence in some patients). Deschloro Cetirizine is considered for quality control purposes only.
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| Additional Infomation |
Deschloro Cetirizine diHCl is a pharmaceutical reference standard, not an active drug substance. It is not FDA-approved for therapeutic use. It is used as an impurity standard for Cetirizine in pharmaceutical quality control and for EP/JP/USP impurity method development. Cetirizine is an over-the-counter (OTC) antihistamine approved for allergic rhinitis and urticaria.
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| Molecular Formula |
C21H26N2O3.2[HCL]
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|---|---|
| Molecular Weight |
427.36462
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| Exact Mass |
426.148
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| CAS # |
83881-54-3
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| PubChem CID |
3068852
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| Appearance |
White to off-white solid powder
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| Boiling Point |
515.6ºC at 760 mmHg
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| Flash Point |
265.6ºC
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| LogP |
3.974
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| Hydrogen Bond Donor Count |
3
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| Hydrogen Bond Acceptor Count |
5
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| Rotatable Bond Count |
8
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| Heavy Atom Count |
28
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| Complexity |
394
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| Defined Atom Stereocenter Count |
0
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| InChi Key |
KODBQWPTPNAKJM-UHFFFAOYSA-N
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| InChi Code |
InChI=1S/C21H26N2O3.2ClH/c24-20(25)17-26-16-15-22-11-13-23(14-12-22)21(18-7-3-1-4-8-18)19-9-5-2-6-10-19;;/h1-10,21H,11-17H2,(H,24,25);2*1H
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| Chemical Name |
2-[2-(4-benzhydrylpiperazin-1-yl)ethoxy]acetic acid;dihydrochloride
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| HS Tariff Code |
2934.99.9001
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| Storage |
Powder -20°C 3 years 4°C 2 years In solvent -80°C 6 months -20°C 1 month Note: Please store this product in a sealed and protected environment (e.g. under nitrogen), avoid exposure to moisture and light. |
| Shipping Condition |
Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs)
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| Solubility (In Vitro) |
DMSO : ~100 mg/mL (~233.99 mM)
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|---|---|
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.5 mg/mL (5.85 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 (5.85 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. View More
Solubility in Formulation 3: ≥ 2.5 mg/mL (5.85 mM) (saturation unknown) in 10% DMSO + 90% Corn Oil (add these co-solvents sequentially from left to right, and one by one), clear solution. |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 2.3399 mL | 11.6997 mL | 23.3995 mL | |
| 5 mM | 0.4680 mL | 2.3399 mL | 4.6799 mL | |
| 10 mM | 0.2340 mL | 1.1700 mL | 2.3399 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.
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.