MedKoo Cat#: 531362 | Name: PF-06422913
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Description:

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

PF-06422913 is an orally active, potent and selective metabotropic glutamate receptor 5 (mGluR5) negative allosteric modulator.

Chemical Structure

PF-06422913
CAS#1539296-46-2

Theoretical Analysis

MedKoo Cat#: 531362

Name: PF-06422913

CAS#: 1539296-46-2

Chemical Formula: C18H13F3N6O

Exact Mass: 386.1103

Molecular Weight: 386.34

Elemental Analysis: C, 55.96; H, 3.39; F, 14.75; N, 21.75; O, 4.14

Price and Availability

Size Price Availability Quantity
5mg USD 500.00
25mg USD 950.00
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Related CAS #
No Data
Synonym
PF-06422913
IUPAC/Chemical Name
1-Methyl-6-(2-pyridinylmethoxy)-3-[4-(trifluoromethyl)-3-pyridinyl]-1H-pyrazolo[3,4-b]prazine
InChi Key
UHUFBNVEMLJTKS-UHFFFAOYSA-N
InChi Code
InChI=1S/C18H13F3N6O/c1-27-17-16(15(26-27)12-8-22-7-5-13(12)18(19,20)21)24-9-14(25-17)28-10-11-4-2-3-6-23-11/h2-9H,10H2,1H3
SMILES Code
FC(C1=C(C2=NN(C)C3=NC(OCC4=NC=CC=C4)=CN=C32)C=NC=C1)(F)F
Appearance
Solid powder
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
Soluble in DMSO
Shelf Life
>3 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
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
Product Data
Biological target:
PF-06422913 is an orally active, potent and selective metabotropic glutamate receptor 5 (mGluR5) negative allosteric modulator.
In vitro activity:
TBD
In vivo activity:
TBD

Preparing Stock Solutions

The following data is based on the product molecular weight 386.34 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
Formulation protocol:
TBD
In vitro protocol:
TBD
In vivo protocol:
TBD
Palanisamy GS, Marcek JM, Cappon GD, Whritenour J, Shaffer CL, Brady JT, Houle C. Drug-induced Skin Lesions in Cynomolgus Macaques Treated with Metabotropic Glutamate Receptor 5 (mGluR5) Negative Allosteric Modulators. Toxicol Pathol. 2015 Oct;43(7):995-1003. doi: 10.1177/0192623315588114. Epub 2015 Jun 9. PMID: 26059827. Emmitte, K. A. (2017). mGlu5 negative allosteric modulators: a patent review (2013-2016). Expert opinion on therapeutic patents, 27(6), 691-706.