MedKoo Cat#: 128778 | Name: TK-685

Description:

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

TK-685 is a potent and selective allosteric SHP2 inhibitor with SHP2WT IC50 =1.5 nM; Ki = 0.87 nM), likely binding to the “tunnel” allosteric site of SHP2. By targeting SHP2-mediated AKT and ERK signaling pathways, TK-685 suppressed cell proliferation and induced apoptosis in esophageal cancer cells. Additionally, oral administration of TK-685 demonstrated good antitumor effects in the KYSE-150 xenograft mouse model, with a T/C value of 76.8%.

Chemical Structure

TK-685
TK-685
CAS#N/A

Theoretical Analysis

MedKoo Cat#: 128778

Name: TK-685

CAS#: N/A

Chemical Formula: C18H20Cl2N6OS

Exact Mass: 438.0796

Molecular Weight: 439.36

Elemental Analysis: C, 49.21; H, 4.59; Cl, 16.14; N, 19.13; O, 3.64; S, 7.30

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
TK-685; TK 685; TK685
IUPAC/Chemical Name
6-(4-(aminomethyl)-4-methylpiperidin-1-yl)-3-((2,3-dichlorophenyl)thio)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
InChi Key
RCLHUHAWRLOVKE-UHFFFAOYSA-N
InChi Code
InChI=1S/C18H20Cl2N6OS/c1-18(9-21)5-7-26(8-6-18)17-22-14-12(15(27)23-17)16(25-24-14)28-11-4-2-3-10(19)13(11)20/h2-4H,5-9,21H2,1H3,(H2,22,23,24,25,27)
SMILES Code
ClC1=C(Cl)C(SC2=NNC(N=C(N3CCC(C)(CN)CC3)N4)=C2C4=O)=CC=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 439.36 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
Song Y, Ren X, Yang X, Xiong J, Wang W, Tang K, Yu B. Structure-Guided Design of Pyrazolopyrimidinones as Highly Potent and Selective Allosteric SHP2 Inhibitors. J Med Chem. 2025 Apr 16. doi: 10.1021/acs.jmedchem.5c00524. Epub ahead of print. PMID: 40235316.