| Size | Price | Stock | Qty |
|---|---|---|---|
| 5mg |
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| 10mg |
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| 50mg |
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| Other Sizes |
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| ln Vitro |
The CID 2745687 (CID2745687) Ki for ERK1/2 phosphorylation using 1 μM Pamoic acid as the agonist is 18 nM[1]. In β-arrestin-2 interaction experiments, CID 2745687 (CID-2745687) is a strong antagonist limited to human GPR35 [2]. With an agonist concentration of 20 μM Zaprinast and the BRET-based GPR35-β-arrestin-2 interaction test, CID 2745687 exhibited moderate potency and concentration dependence at human GPR35, with a pIC50 of 6.70±0.09[2]. CID 2745687 (pIC50=6.27±0.08) completely counteracts Cromolyn disodium's agonistic effects [2].
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|---|---|
| ln Vivo |
A particular GPR35 antagonist, CID 2745687 (CID2745687; 1 mg/kg; taken orally daily for the last 4 weeks), counteracts the anti-fibrotic effects of lodoxamide[3].
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| Animal Protocol |
Animal/Disease Models: Sixweeks old male C57BL/6 mice[3]
Doses: 1 mg/kg Route of Administration: Oral administration, every day for 4 weeks Experimental Results: Inhibited Lodoxamide-mediated protective effects. |
| References |
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| Additional Infomation |
5-[[[(tert-butylamino)-sulfanylidenemethyl]hydrazinylidene]methyl]-1-(2,4-difluorophenyl)-4-pyrazolecarboxylic acid methyl ester is a ring assembly and a member of pyrazoles.
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| Molecular Formula |
C17H19F2N5O2S
|
|---|---|
| Molecular Weight |
395.43
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| Exact Mass |
395.122
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| CAS # |
264233-05-8
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| PubChem CID |
9581011
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| Appearance |
Off-white to light yellow solid powder
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| Density |
1.3±0.1 g/cm3
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| Boiling Point |
493.6±55.0 °C at 760 mmHg
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| Flash Point |
252.3±31.5 °C
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| Vapour Pressure |
0.0±1.3 mmHg at 25°C
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| Index of Refraction |
1.591
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| LogP |
3.05
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| Hydrogen Bond Donor Count |
2
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| Hydrogen Bond Acceptor Count |
7
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| Rotatable Bond Count |
6
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| Heavy Atom Count |
27
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| Complexity |
572
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| Defined Atom Stereocenter Count |
0
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| SMILES |
CC(C)(C)NC(=S)N/N=C/C1=C(C=NN1C2=C(C=C(C=C2)F)F)C(=O)OC
|
| InChi Key |
CYNLZIBKERMMOA-AWQFTUOYSA-N
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| InChi Code |
InChI=1S/C17H19F2N5O2S/c1-17(2,3)22-16(27)23-20-9-14-11(15(25)26-4)8-21-24(14)13-6-5-10(18)7-12(13)19/h5-9H,1-4H3,(H2,22,23,27)/b20-9+
|
| Chemical Name |
methyl 5-[(E)-(tert-butylcarbamothioylhydrazinylidene)methyl]-1-(2,4-difluorophenyl)pyrazole-4-carboxylate
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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 |
| 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: 125 mg/mL (316.11 mM)
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|---|---|
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.08 mg/mL (5.26 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 20.8 mg/mL clear DMSO stock solution to 900 μL of corn oil and mix evenly. (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 2.5289 mL | 12.6445 mL | 25.2889 mL | |
| 5 mM | 0.5058 mL | 2.5289 mL | 5.0578 mL | |
| 10 mM | 0.2529 mL | 1.2644 mL | 2.5289 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.
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