PeptideDB

β-catenin-IN-2 1458664-10-2

β-catenin-IN-2 1458664-10-2

CAS No.: 1458664-10-2

β-catenin-IN-2 is a potent β-catenin inhibitor, compound H1B1, disclosed in patent US20150374662A1. β-catenin-IN-2 ma
Data collection:peptidedb@qq.com

This product is for research use only, not for human use. We do not sell to patients.

β-catenin-IN-2 is a potent β-catenin inhibitor, compound H1B1, disclosed in patent US20150374662A1. β-catenin-IN-2 may be used in colorectal cancer research.

Physicochemical Properties


Molecular Formula C15H14FN3
Molecular Weight 255.290166378021
Exact Mass 255.117
CAS # 1458664-10-2
PubChem CID 60979451
Appearance Pink to red solid powder
LogP 3.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Heavy Atom Count 19
Complexity 302
Defined Atom Stereocenter Count 0
SMILES

FC1C=CC2=C(C=1)NC(C1C=CC(=CC=1)N(C)C)=N2

InChi Key ALWZHAOGGMSYPG-UHFFFAOYSA-N
InChi Code

InChI=1S/C15H14FN3/c1-19(2)12-6-3-10(4-7-12)15-17-13-8-5-11(16)9-14(13)18-15/h3-9H,1-2H3,(H,17,18)
Chemical Name

4-(6-fluoro-1H-benzimidazol-2-yl)-N,N-dimethylaniline
HS Tariff Code 2934.99.9001
Storage

Powder-20°C 3 years

4°C 2 years

In solvent -80°C 6 months

-20°C 1 month

Shipping Condition Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs)

Biological Activity


ln Vitro In HCT116 cells, β-catenin/Tcf-4 transcriptional activity is dose-dependently inhibited by β-catenin-IN-2 (10–40 μM) [1].
References

[1]. Inhibitors of beta-catenin in treatment of colorectal cancer. Patent US20150374662A1.


Solubility Data


Solubility (In Vitro) DMSO: 83.33 mg/mL (326.41 mM)
Solubility (In Vivo) Solubility in Formulation 1: ≥ 2.08 mg/mL (8.15 mM) (saturation unknown) in 10% DMSO + 90% Corn Oil (add these co-solvents sequentially from left to right, and one by one), clear solution.
For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 20.8 mg/mL clear DMSO stock solution to 900 μL of corn oil and mix evenly.

 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 3.9171 mL 19.5856 mL 39.1711 mL
5 mM 0.7834 mL 3.9171 mL 7.8342 mL
10 mM 0.3917 mL 1.9586 mL 3.9171 mL
*Note: Please select an appropriate solvent for the preparation of stock solution based on your experiment needs. For most products, DMSO can be used for preparing stock solutions (e.g. 5 mM, 10 mM, or 20 mM concentration); some products with high aqueous solubility may be dissolved in water directly. Solubility information is available at the above Solubility Data section. Once the stock solution is prepared, aliquot it to routine usage volumes and store at -20°C or -80°C. Avoid repeated freeze and thaw cycles.