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MedKoo Cat#: 208263 | Name: TTK PROTAC 8j

Description:

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

TTK PROTAC 8j demonstrated strong TTK degradation in COLO-205 human colorectal cancer cells with DC50 values of 1.7 and 3.1 nM, respectively.

Chemical Structure

TTK PROTAC 8j
TTK PROTAC 8j
CAS#unknown

Theoretical Analysis

MedKoo Cat#: 208263

Name: TTK PROTAC 8j

CAS#: unknown

Chemical Formula: C49H57N9O7

Exact Mass: 883.4381

Molecular Weight: 884.05

Elemental Analysis: C, 66.57; H, 6.50; N, 14.26; O, 12.67

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
TTK PROTAC 8j, TTK PROTAC 8j, TTK PROTAC 8j
IUPAC/Chemical Name
N-((1s,4s)-4-(2-((4-(4-(8-(2-(2,6-Dioxopiperidin-3-yl)-3-oxoisoindolin-5-yl)oct-7-ynoyl)piperazin-1-yl)-2-methoxyphenyl)amino)-5-methyl-7-oxopyrido[2,3-d]pyrimidin-8(7H)-yl)cyclohexyl)propionamide
InChi Key
XWOZFCIASHOPCP-UKMVIOKASA-N
InChi Code
InChI=1S/C49H57N9O7/c1-4-42(59)51-34-14-16-35(17-15-34)58-45(62)26-31(2)38-29-50-49(54-46(38)58)52-39-19-18-36(28-41(39)65-3)55-22-24-56(25-23-55)44(61)11-9-7-5-6-8-10-32-12-13-33-30-57(48(64)37(33)27-32)40-20-21-43(60)53-47(40)63/h12-13,18-19,26-29,34-35,40H,4-7,9,11,14-17,20-25,30H2,1-3H3,(H,51,59)(H,50,52,54)(H,53,60,63)/t34-,35+,40?
SMILES Code
CCC(N[C@H]1CC[C@@H](N(C2=NC(NC3=CC=C(N4CCN(C(CCCCCC#CC5=CC6=C(CN(C(CC7)C(NC7=O)=O)C6=O)C=C5)=O)CC4)C=C3OC)=NC=C2C(C)=C8)C8=O)CC1)=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
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 884.05 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
Lu J, Huang Y, Huang J, He R, Huang M, Lu X, Xu Y, Zhou F, Zhang Z, Ding K. Discovery of the First Examples of Threonine Tyrosine Kinase PROTAC Degraders. J Med Chem. 2022 Feb 10;65(3):2313-2328. doi: 10.1021/acs.jmedchem.1c01768. Epub 2022 Jan 27. PMID: 35084180.