WARNING: This product is for research use only, not for human or veterinary use.
Hodoodo CAT#: H130531
CAS#: MRS4853
Description: MRS4853 is a novel human P2Y6 receptor antagonist (IC50 0.46 µM).
Hodoodo Cat#: H130531
Name: MRS4853
CAS#: MRS4853
Chemical Formula: C18H20F3NO3Si
Exact Mass: 383.12
Molecular Weight: 383.440
Elemental Analysis: C, 56.38; H, 5.26; F, 14.86; N, 3.65; O, 12.52; Si, 7.32
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Synonym: MRS-4853, MRS 4853
IUPAC/Chemical Name: Triethyl((3-nitro-2-(trifluoromethyl)-2H-chromen-8-yl)ethynyl)silane
InChi Key: IHIRLDQLFPQTJC-UHFFFAOYSA-N
InChi Code: InChI=1S/C18H20F3NO3Si/c1-4-26(5-2,6-3)11-10-13-8-7-9-14-12-15(22(23)24)17(18(19,20)21)25-16(13)14/h7-9,12,17H,4-6H2,1-3H3
SMILES Code: FC(C1C([N+]([O-])=O)=CC2=C(O1)C(C#C[Si](CC)(CC)CC)=CC=C2)(F)F
Appearance: To be determined
Purity: >98% (or refer to the Certificate of Analysis)
Shipping Condition: Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition: Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility: To be determined
Shelf Life: >2 years if stored properly
Drug Formulation: To be determined
Stock Solution Storage: 0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code: 2934.99.9001
More Info:
Biological target: | |
In vitro activity: | |
In vivo activity: |
The following data is based on the product molecular weight 383.44 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.
Concentration / Solvent Volume / Mass | 1 mg | 5 mg | 10 mg |
---|---|---|---|
1 mM | 1.15 mL | 5.76 mL | 11.51 mL |
5 mM | 0.23 mL | 1.15 mL | 2.3 mL |
10 mM | 0.12 mL | 0.58 mL | 1.15 mL |
50 mM | 0.02 mL | 0.12 mL | 0.23 mL |
Formulation protocol: | |
In vitro protocol: | |
In vivo protocol: |
1. Jung YH, Shah Q, Lewicki SA, Pramanik A, Gopinatth V, Pelletier J, Sévigny J, Iqbal J, Jacobson KA. Synthesis and pharmacological characterization of multiply substituted 2H-chromene derivatives as P2Y6 receptor antagonists. Bioorg Med Chem Lett. 2022 Nov 1;75:128981. doi: 10.1016/j.bmcl.2022.128981. Epub 2022 Sep 8. PMID: 36089113; PMCID: PMC9555146.