MedKoo Cat#: 208219 | Name: MRGPRX1 PAM 1t

Description:

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

MRGPRX1 PAM 1t is a positive allosteric modulator (PAM) of MRGPRX1. It has the potential to preferentially activate the receptors at the central terminals of primary sensory neurons and minimize itch side effects caused by peripheral activation.

Chemical Structure

MRGPRX1 PAM 1t
MRGPRX1 PAM 1t
CAS#unknown

Theoretical Analysis

MedKoo Cat#: 208219

Name: MRGPRX1 PAM 1t

CAS#: unknown

Chemical Formula: C23H17Cl2F3N2O2S

Exact Mass: 512.0340

Molecular Weight: 513.36

Elemental Analysis: C, 53.81; H, 3.34; Cl, 13.81; F, 11.10; N, 5.46; O, 6.23; S, 6.25

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 #
No Data
Synonym
MRGPRX1 PAM1t, MRGPRX1-PAM 1t, MRGPRX1-PAM-1t
IUPAC/Chemical Name
6-(tert-Butyl)-5-(3,4-dichlorophenyl)-4-(2-(trifluoromethoxy)phenoxy)thieno[2,3-d]pyrimidine
InChi Key
VNOJQHCKVSWTKW-UHFFFAOYSA-N
InChi Code
InChI=1S/C23H17Cl2F3N2O2S/c1-22(2,3)19-17(12-8-9-13(24)14(25)10-12)18-20(29-11-30-21(18)33-19)31-15-6-4-5-7-16(15)32-23(26,27)28/h4-11H,1-3H3
SMILES Code
FC(F)(F)OC1=CC=CC=C1OC2=C(C(C3=CC=C(Cl)C(Cl)=C3)=C(C(C)(C)C)S4)C4=NC=N2
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
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 513.36 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
Berhane, Ilyas, et al. "Thieno [2, 3-d] pyrimidine-Based Positive Allosteric Modulators of Human Mas-Related G Protein-Coupled Receptor X1 (MRGPRX1)." Journal of medicinal chemistry 65.4 (2022): 3218-3228.