KY0211

Base Information

• Chemical Name: KY0211
• CAS No.: 1118807-13-8
• Molecular Formula: C18H17ClN2O3S
• Molecular Weight: 376.85718
• European Community (EC) Number: 808-505-5
• UNII: 6AXH36YF6M
• DSSTox Substance ID: DTXSID80429194
• Nikkaji Number: J3.159.754D
• Wikidata: Q72517295
• ChEMBL ID: CHEMBL3186128
• Mol file: 1118807-13-8.mol

Synonyms:KY0211;KY02111;KY02111 / KY-02111;N-(6-Chloro-2-benzothiazolyl)-3,4-dimethoxybenzenepropanamide;Benzenepropanamide, N-(6-chloro-2-benzothiazolyl)-3,4-dimethoxy-;KY0211 N-(6-Chloro-2-benzothiazolyl)-3,4-dimethoxybenzenepropanamide;N-(6-Chloro-2-benzothiazolyl)-3,4-dimethoxybenzenepropanamide KY02111;KY02111, >=98%

Chemical Property of KY0211

Chemical Property:

• PKA: 9.92±0.70(Predicted)
• PSA: 92.18000
• Density: 1.362±0.06 g/cm3(Predicted)
• LogP: 5.18770
• Storage Temp.: 2-8°C
• Solubility.: DMSO: soluble10mg/mL, clear
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 376.0648413
• Heavy Atom Count: 25
• Complexity: 456

Purity/Quality:

98% min ^*data from raw suppliers

KY 02111 ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22
• Safety Statements: 46

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)Cl)OC
• Description: KY-02111 (1118807-13-8) promotes cardiac differentiation of human pluripotent stem cells. Inhibits Wnt signaling in a manner that appears to be distinct from previously described Wnt inhibitors.1 Cell permeable and active in vivo.
• Uses: KY 0211, allows for inducing differentiation of pluripotent stem cell into cardiac muscle.

Technology Process of KY0211

There total 1 articles about KY0211 which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 72.0%

→ 2-(3-(3,4-dimethoxyphenyl)propanamido)-6-chlorobenzothiazole (1118807-13-8)

Guidance literature:

With triethylamine; In dichloromethane; at 20 ℃; for 1h;

Reference yield:

2-(3-(3,4-dimethoxyphenyl)propanamido)-6-chlorobenzothiazole (1118807-13-8) + methyl iodide (74-88-4) → N-(6-chlorobenzo[d]thiazol-2-yl)-3-(3,4-dimethoxyphenyl)-N-methylpropanamide

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 1h;

DOI:10.1002/anie.202100523

Refernces