Caspase-4-IN-1
Based on 1 Customer Validation
Caspase-4-IN-1 (compound 35) is a selective allosteric caspase-4 inhibitor that spares caspase-1, and in embodiments acts as a dual caspase-4/5 inhibitor.
For research use only. We do not sell to patients.
- Purity : 98.27%
- CAS No.: 3121390-12-0
- Formula: C27H23ClFN5O3
- Molecular Weight:519.95
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Storage:Powder -20°C, 3 years , 4°C, 2 years ; In solvent -80°C, 6 months , -20°C, 1 month
To place orders, for customer services and technical support, please contact: MedChemExpress USA
Tel: 609-228-6898 E-mail: [email protected] [email protected]
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Biological Activity
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Chemical Information
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Solvent & Solubility
- Purity & Documentation
- References
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Help & FAQs
All Caspase Isoforms
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Biological Activity
Description
IC50 & Target
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Caspase-4 |
Parmacokinetics
| Species | Dose | Route | T1/2 | Tmax | Cmax | MRT0-inf | CL/F | Vz/F | AUC0-t | AUC0-inf | Bioavailability |
|---|---|---|---|---|---|---|---|---|---|---|---|
| Cynomolgus Monkey[1] | 5 mg/kg | p.o. | 2.20 h | 4 h | 68.4 ng/mL | 5.16 h | 237 mL/min/kg | 45.9 L/kg | 386 ng·h/mL | 402 ng·h/mL | 4.03 % |
| Cynomolgus Monkey[1] | 5 mg/kg | p.o. | 2.20 h | 4 h | 68.4 ng/mL | 5.16 h | 237 mL/min/kg | 45.9 L/kg | 386 ng·h/mL | 402 ng·h/mL | 4.03 % |
| Mice[1] | 5 mg/kg | p.o. | 2.20 h | 4 h | 68.4 ng/mL | 5.16 h | 237 mL/min/kg | 45.9 L/kg | 386 ng·h/mL | 402 ng·h/mL | 4.03 % |
Chemical Information
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CAS No. 3121390-12-0
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Appearance Solid
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Molecular Weight 519.95
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Formula C27H23ClFN5O3
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Color Off-white to light yellow
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SMILES
O=C1C2=C(C=C(C3=CC=CC(OC)=C3C#N)C=N2)N=C(C4=C(F)C=C(O[C@@H]5C[C@H](N)C5)C(Cl)=C4)N1CC
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Shipping
Room temperature in continental US; may vary elsewhere.
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Storage
Powder -20°C 3 years 4°C 2 years In solvent -80°C 6 months -20°C 1 month
Solvent & Solubility
In Vitro:
DMSO : 100 mg/mL (192.33 mM; Need ultrasonic; Hygroscopic DMSO has a significant impact on the solubility of product, please use newly opened DMSO)
Please refer to the solubility information to select the appropriate solvent. Once prepared, please aliquot and store the solution to prevent product inactivation from repeated freeze-thaw cycles.
Storage method and period of stock solution: -80°C, 6 months; -20°C, 1 month. When stored at -80°C, please use it within 6 months. When stored at -20°C, please use it within 1 month.
Please refer to the solubility information to select the appropriate solvent. Once prepared, please aliquot and store the solution to prevent product inactivation from repeated freeze-thaw cycles.
Storage method and period of stock solution: -80°C, 6 months; -20°C, 1 month. When stored at -80°C, please use it within 6 months. When stored at -20°C, please use it within 1 month.
Concentration (start) × Volume (start) = Concentration (final) × Volume (final)
In Vivo:
Select the appropriate dissolution method based on your experimental animal and administration route.
- For the following dissolution methods, please ensure to first prepare a clear stock solution using an In Vitro approach and then sequentially add co-solvents:
- To ensure reliable experimental results, the clarified stock solution can be appropriately stored based on storage conditions. As for the working solution for In Vivo experiments, it is recommended to prepare freshly and use it on the same day.
- The percentages shown for the solvents indicate their volumetric ratio in the final prepared solution. If precipitation or phase separation occurs during preparation, heat and/or sonication can be used to aid dissolution.
Add each solvent one by one: 10% DMSO 40% PEG300 5% Tween-80 45% Saline
Solubility: ≥ 2.5 mg/mL (4.81 mM); Clear solution
This protocol yields a clear solution of ≥ 2.5 mg/mL (saturation unknown).
Taking 1 mL working solution as an example, add 100 μL DMSO stock solution (25.0 mg/mL) to 400 μL PEG300, and mix evenly; then add 50 μL Tween-80 and mix evenly; then add 450 μL Saline to adjust the volume to 1 mL.
Preparation of Saline: Dissolve 0.9 g sodium chloride in ddH₂O and dilute to 100 mL to obtain a clear Saline solution.
Add each solvent one by one: 10% DMSO 90% (20% SBE-β-CD in Saline)
Solubility: ≥ 2.5 mg/mL (4.81 mM); Clear solution
This protocol yields a clear solution of ≥ 2.5 mg/mL (saturation unknown).
Taking 1 mL working solution as an example, add 100 μL DMSO stock solution (25.0 mg/mL) to 900 μL 20% SBE-β-CD in Saline, and mix evenly.
Preparation of 20% SBE-β-CD in Saline (4°C, storage for one week): 2 g SBE-β-CD powder is dissolved in 10 mL Saline, completely dissolve until clear.
In Vivo Dissolution Calculator
Please enter the basic information of animal experiments:
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Recommended: Prepare an additional quantity of animals to account for potential losses during experiments.
Please enter your animal formula composition:
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%DMSO +
Recommended: Keep the proportion of DMSO in working solution below 2% if your animal is weak.
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%+
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+%Tween-80 + +
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%Saline +
The co-solvents required include: DMSO, . All of co-solvents are available by MedChemExpress (MCE). , Tween 80. All of co-solvents are available by MedChemExpress (MCE).
Working solution concentration: 0.22 mg/mL
Method for preparing stock solution: mg drug dissolved in μL DMSO. Stock solution concentration: mg/mL.
1. Take μL DMSO stock solution;
2. Add μL .
μL , mix evenly;
3. Then add μL Tween 80, mix evenly;
4. Then add μL
Please ensure that the stock solution in the first step is dissolved to a clear state, and add co-solvents in sequence. You can use ultrasonic heating (ultrasonic cleaner, recommended frequency 20-40 kHz), vortexing, etc. to assist dissolution.
Purity & Documentation
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Data Sheet (269 KB)
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SDS (252 KB)
- English - EN (252 KB)
- Français - FR (252 KB)
- Deutsch - DE (252 KB)
- Norwegian - NO (252 KB)
- Español - ES (252 KB)
- Swedish - SV (252 KB)
- Italian - IT (252 KB)
- Korean - KR (252 KB)
- Portuguese - PT (252 KB)
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Handling Instructions (2659 KB)
References
Complete Stock Solution Preparation Table
Please refer to the solubility information to select the appropriate solvent. Once prepared, please aliquot and store the solution to prevent product inactivation from repeated freeze-thaw cycles.
Storage method and period of stock solution: -80°C, 6 months; -20°C, 1 month. When stored at -80°C, please use it within 6 months. When stored at -20°C, please use it within 1 month.
| Optional Solvent | Concentration Solvent Mass | 1 mg | 5 mg | 10 mg | 25 mg |
|---|---|---|---|---|---|
| DMSO | 1 mM | 1.9233 mL | 9.6163 mL | 19.2326 mL | 48.0815 mL |
| 5 mM | 0.3847 mL | 1.9233 mL | 3.8465 mL | 9.6163 mL | |
| 10 mM | 0.1923 mL | 0.9616 mL | 1.9233 mL | 4.8082 mL | |
| 15 mM | 0.1282 mL | 0.6411 mL | 1.2822 mL | 3.2054 mL | |
| 20 mM | 0.0962 mL | 0.4808 mL | 0.9616 mL | 2.4041 mL | |
| 25 mM | 0.0769 mL | 0.3847 mL | 0.7693 mL | 1.9233 mL | |
| 30 mM | 0.0641 mL | 0.3205 mL | 0.6411 mL | 1.6027 mL | |
| 40 mM | 0.0481 mL | 0.2404 mL | 0.4808 mL | 1.2020 mL | |
| 50 mM | 0.0385 mL | 0.1923 mL | 0.3847 mL | 0.9616 mL | |
| 60 mM | 0.0321 mL | 0.1603 mL | 0.3205 mL | 0.8014 mL | |
| 80 mM | 0.0240 mL | 0.1202 mL | 0.2404 mL | 0.6010 mL | |
| 100 mM | 0.0192 mL | 0.0962 mL | 0.1923 mL | 0.4808 mL |
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