MedKoo Cat#: 121072 | Name: Edecesertib
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Description:

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

Edecesertib, also known as GS-5718, is a serine/threonine kinase inhibitor and anti-inflammatory. Edecesertib can be used for lupus erythematosus (LE) and rheumatoid arthritis (RA) research. Edecesertib (GS-5718) is under development for the treatment of lupus and cutaneous lupus erythematosus (CLE). The drug candidate acts by targeting interleukin-1 receptor-associated kinase 4 (IRAK4). It is administered through oral route.

Chemical Structure

Edecesertib
Edecesertib
CAS#2408839-73-4

Theoretical Analysis

MedKoo Cat#: 121072

Name: Edecesertib

CAS#: 2408839-73-4

Chemical Formula: C22H22FN7O2

Exact Mass: 435.1819

Molecular Weight: 435.46

Elemental Analysis: C, 60.68; H, 5.09; F, 4.36; N, 22.52; O, 7.35

Price and Availability

Size Price Availability Quantity
5mg USD 950.00 2 Weeks
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Related CAS #
No Data
Synonym
Edecesertib, GS-5718; GS 5718; GS5718;
IUPAC/Chemical Name
4-{[(1R)-1-cyanoethyl]amino}-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-N-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]pyridine-3-carboxamide
InChi Key
HORBHQPSWJRDSV-LCNBYPMKSA-N
InChi Code
InChI=1S/C22H22FN7O2/c1-13(8-24)29-17-7-18(19-5-4-15-6-14(9-25)10-28-30(15)19)26-11-16(17)21(31)27-12-20(23)22(2,3)32/h4-7,10-11,13,20,32H,12H2,1-3H3,(H,26,29)(H,27,31)/t13?,20-/m1/s1
SMILES Code
C[C@]([H])(C#N)NC1=C(C(NC[C@@]([H])(F)C(O)(C)C)=O)C=NC(C2=CC=C3N2N=CC(C#N)=C3)=C1
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 435.46 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