MedKoo Cat#: 463124 | Name: IRAK3 degrader 23

Description:

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

IRAK3 degrader 23 is a novel potent and selective degrader of IRAK3, inducing proteasome-dependent degradation of IRAK3 and showing both CRBN and IRAK3 binding for activity.

Chemical Structure

IRAK3 degrader 23
IRAK3 degrader 23
CAS#2712600-00-3

Theoretical Analysis

MedKoo Cat#: 463124

Name: IRAK3 degrader 23

CAS#: 2712600-00-3

Chemical Formula: C47H63N11O6

Exact Mass: 877.4963

Molecular Weight: 878.09

Elemental Analysis: C, 64.29; H, 7.23; N, 17.55; O, 10.93

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 #
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Synonym
IRAK3 degrader 23; IRAK3-degrader-23;
IUPAC/Chemical Name
2-(2,6-dioxopiperidin-3-yl)-5-(4-(2-(1-(4-(4-((1s,4s)-4-((5-isopropylpyrrolo[2,1-f][1,2,4]triazin-4-yl)amino)cyclohexyl)piperazin-1-yl)-4-oxobutanoyl)piperidin-4-yl)ethyl)piperazin-1-yl)isoindoline-1,3-dione
InChi Key
ZUODKONSNNHSAJ-AMLBMYBGSA-N
InChi Code
InChI=1S/C47H63N11O6/c1-31(2)36-16-20-57-43(36)44(48-30-49-57)50-33-3-5-34(6-4-33)53-25-27-56(28-26-53)42(61)12-11-41(60)55-18-14-32(15-19-55)13-17-52-21-23-54(24-22-52)35-7-8-37-38(29-35)47(64)58(46(37)63)39-9-10-40(59)51-45(39)62/h7-8,16,20,29-34,39H,3-6,9-15,17-19,21-28H2,1-2H3,(H,48,49,50)(H,51,59,62)/t33-,34+,39?
SMILES Code
O=C(N(C1C(NC(CC1)=O)=O)C2=O)C3=C2C=C(C=C3)N(CC4)CCN4CCC(CC5)CCN5C(CCC(N(CC6)CCN6[C@H]7CC[C@@H](NC8=NC=NN9C8=C(C(C)C)C=C9)CC7)=O)=O
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

Preparing Stock Solutions

The following data is based on the product molecular weight 878.09 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: Degorce SL, Tavana O, Banks E, Crafter C, Gingipalli L, Kouvchinov D, Mao Y, Pachl F, Solanki A, Valge-Archer V, Yang B, Edmondson SD. Discovery of Proteolysis-Targeting Chimera Molecules that Selectively Degrade the IRAK3 Pseudokinase. J Med Chem. 2020 Sep 24;63(18):10460-10473. doi: 10.1021/acs.jmedchem.0c01125. Epub 2020 Sep 14. PMID: 32803978. 2: Alonso S, Mayol X, Nonell L, Salvans S, Pascual M, Pera M; Colorectal Cancer Research Group (Hospital del Mar Medical Research Institute). Peripheral blood leucocytes show differential expression of tumour progression-related genes in colorectal cancer patients who have a postoperative intra-abdominal infection: a prospective matched cohort study. Colorectal Dis. 2017 May;19(5):O115-O125. doi: 10.1111/codi.13635. PMID: 28214365.