TAI-1

Base Information

• Chemical Name: TAI-1
• CAS No.: 1334921-03-7
• Molecular Formula: C₂₄H₂₁N₃O₃S
• Molecular Weight: 431.515
• Mol file: 1334921-03-7.mol

Synonyms:N-{4-[4-(4-methoxyphenoxy)-2,6-dimethylphenyl]thiazol-2-yl}pyridine-4-carboxamide

Chemical Property of TAI-1

Chemical Property:

• PKA: 5.38±0.70(Predicted)
• Density: 1.281±0.06 g/cm3(Predicted)
• Solubility.: ≥43.2 mg/mL in DMSO; insoluble in H2O; ≥3.17 mg/mL in EtOH

Purity/Quality:

99%+, ^*data from raw suppliers

TAI-1 >98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of TAI-1

There total 6 articles about TAI-1 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: 95.0%

4-(chlorocarbonyl)pyridine (14254-57-0) + 4-(4-(4-methoxyphenoxy)-2,6-dimethylphenyl)thiazol-2-amine (1334922-24-5) → N-{4-[4-(4-methoxyphenoxy)-2,6-dimethylphenyl]thiazol-2-yl}pyridine-4-carboxamide (1334921-03-7)

Guidance literature:

With dmap; In dichloromethane; at 20 ℃; for 12h; Inert atmosphere;

DOI:10.1021/jm401990s

Reference yield: 95.0%

→ N-{4-[4-(4-methoxyphenoxy)-2,6-dimethylphenyl]thiazol-2-yl}pyridine-4-carboxamide (1334921-03-7)

Guidance literature:

Reference yield:

1-(4-(4-methoxyphenoxy)-2,6-dimethylphenyl)ethanone (1334922-19-8) → N-{4-[4-(4-methoxyphenoxy)-2,6-dimethylphenyl]thiazol-2-yl}pyridine-4-carboxamide (1334921-03-7)

Guidance literature:

Multi-step reaction with 3 steps

1: tetra-N-butylammonium tribromide / acetonitrile / 1.33 h / 20 °C

2: ethanol / 1 h / Reflux

3: dmap / dichloromethane / 12 h / 20 °C / Inert atmosphere

With dmap; tetra-N-butylammonium tribromide; In ethanol; dichloromethane; acetonitrile;

DOI:10.1021/jm401990s

upstream raw materials:

1-(4-(4-methoxyphenoxy)-2,6-dimethylphenyl)ethanone

4-(chlorocarbonyl)pyridine

4-(4-(4-methoxyphenoxy)-2,6-dimethylphenyl)thiazol-2-amine

1-(4-chloro-2,6-dimethylphenyl)ethanone

Refernces

• 1、 -. "Modulators Of HEC1 Activity And Methods Therefor". Page/Page column 44. . Retrieved 2011/10/10.