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MedKoo Cat#: 128395 | Name: SJ3149

Description:

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

SJ3149 is a CK1α Molecular glue degrader.

Chemical Structure

SJ3149
SJ3149
CAS#3026986-17-1

Theoretical Analysis

MedKoo Cat#: 128395

Name: SJ3149

CAS#: 3026986-17-1

Chemical Formula: C20H16N4O4

Exact Mass: 376.1172

Molecular Weight: 376.37

Elemental Analysis: C, 63.83; H, 4.29; N, 14.89; O, 17.00

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.
Bulk Inquiry
Related CAS #
No Data
Synonym
SJ3149; SJ 3149; SJ-3149
IUPAC/Chemical Name
3-(5-(benzo[d]isoxazol-3-ylamino)-1-oxoisoindolin-2-yl)piperidine-2,6-dione
InChi Key
AJUZTJBGJWQZFW-UHFFFAOYSA-N
InChi Code
InChI=1S/C20H16N4O4/c25-17-8-7-15(19(26)22-17)24-10-11-9-12(5-6-13(11)20(24)27)21-18-14-3-1-2-4-16(14)28-23-18/h1-6,9,15H,7-8,10H2,(H,21,23)(H,22,25,26)
SMILES Code
O=C1N(C2C(NC(CC2)=O)=O)CC3=C1C=CC(NC4=NOC5=C4C=CC=C5)=C3
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 376.37 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: Nishiguchi G, Mascibroda LG, Young SM, Caine EA, Abdelhamed S, Kooijman JJ, Miller DJ, Das S, McGowan K, Mayasundari A, Shi Z, Barajas JM, Hiltenbrand R, Aggarwal A, Chang Y, Mishra V, Narina S, Thomas M, Loughran AJ, Kalathur R, Yu K, Zhou S, Wang X, High AA, Peng J, Pruett-Miller SM, Daniels DL, Urh M, Shelat AA, Mullighan CG, Riching KM, Zaman GJR, Fischer M, Klco JM, Rankovic Z. Selective CK1α degraders exert antiproliferative activity against a broad range of human cancer cell lines. Nat Commun. 2024 Jan 16;15(1):482. doi: 10.1038/s41467-024-44698-1. PMID: 38228616; PMCID: PMC10791743. 2: Nishiguchi G, Caine EA, McGowan K, Shi Z, Aggarwal A, Mayasundari A, Price J, Yang L, Li Y, Fu X, Mascibroda LG, Das S, Daniels DL, Urh M, Klco JM, Riching KM, Rankovic Z. Structure-Activity Relationship of Potent, Selective, and Orally Bioavailable Molecular Glue Degraders of CK1α. ACS Med Chem Lett. 2024 Sep 12;15(10):1692-1698. doi: 10.1021/acsmedchemlett.4c00250. PMID: 39411539; PMCID: PMC11472389.