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MedKoo Cat#: 125937 | Name: STX-107 dihydrochloride

Description:

WARNING: This product is for research use only, not for human or veterinary use.

STX-107 is a mGluR5 antagonists (Metabotropic glutamate receptor 5 antagonists).

Chemical Structure

STX-107 dihydrochloride
STX-107 dihydrochloride
CAS#STX-107 dihydrochloride

Theoretical Analysis

MedKoo Cat#: 125937

Name: STX-107 dihydrochloride

CAS#: STX-107 dihydrochloride

Chemical Formula: C18H12Cl2FN3S

Exact Mass: 391.0113

Molecular Weight: 392.27

Elemental Analysis: C, 55.11; H, 3.08; Cl, 18.07; F, 4.84; N, 10.71; S, 8.17

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
935685-90-8 (free base) STX-107 dihydrochloride
Synonym
STX-107 dihydrochloride; STX107; STX 107; STX-107
IUPAC/Chemical Name
3-fluoro-5-(5-((2-methylthiazol-4-yl)ethynyl)pyridin-2-yl)benzonitrile dihydrochloride
InChi Key
NETHQDSSQKPGHM-UHFFFAOYSA-N
InChi Code
InChI=1S/C18H10FN3S.2ClH/c1-12-22-17(11-23-12)4-2-13-3-5-18(21-10-13)15-6-14(9-20)7-16(19)8-15;;/h3,5-8,10-11H,1H3;2*1H
SMILES Code
Cl.Cl.CC1=NC(=CS1)C#CC2=CC=C(N=C2)C3=CC(=CC(F)=C3)C#N
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

Preparing Stock Solutions

The following data is based on the product molecular weight 392.27 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.

Recalculate based on batch purity %
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
1: Arsova A, Møller TC, Vedel L, Hansen JL, Foster SR, Gregory KJ, Bräuner- Osborne H. Detailed In Vitro Pharmacological Characterization of Clinically Tested Negative Allosteric Modulators of the Metabotropic Glutamate Receptor 5. Mol Pharmacol. 2020 Jul;98(1):49-60. doi: 10.1124/mol.119.119032. Epub 2020 May 1. PMID: 32358164; PMCID: PMC7705108. 2: Fu T, Zheng G, Tu G, Yang F, Chen Y, Yao X, Li X, Xue W, Zhu F. Exploring the Binding Mechanism of Metabotropic Glutamate Receptor 5 Negative Allosteric Modulators in Clinical Trials by Molecular Dynamics Simulations. ACS Chem Neurosci. 2018 Jun 20;9(6):1492-1502. doi: 10.1021/acschemneuro.8b00059. Epub 2018 Mar 16. PMID: 29522307.

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