4,5,6,7-Tetrahydro-N-[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]-4-phenyl-2-benzothiazolamine

Base Information

• Chemical Name: 4,5,6,7-Tetrahydro-N-[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]-4-phenyl-2-benzothiazolamine
• CAS No.: 1172637-87-4
• Molecular Formula: C24H24N4OS
• Molecular Weight: 416.547
• Mol file: 1172637-87-4.mol

Synonyms:4,5,6,7-Tetrahydro-N-[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]-4-phenyl-2-benzothiazolamine;

Chemical Property of 4,5,6,7-Tetrahydro-N-[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]-4-phenyl-2-benzothiazolamine

Chemical Property:

• Boiling Point: 617.7±65.0 °C(Predicted)
• PKA: 5.98±0.61(Predicted)
• PSA: 83.44000
• Density: 1.30
• LogP: 5.27950

Purity/Quality:

97% ^*data from raw suppliers

gamma-secretasemodulator1 98+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 4,5,6,7-Tetrahydro-N-[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]-4-phenyl-2-benzothiazolamine

There total 4 articles about 4,5,6,7-Tetrahydro-N-[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]-4-phenyl-2-benzothiazolamine 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:

(RS)-2-phenylcyclohexanone (1444-65-1) → [3-methoxy-4-(4-methyl-imidazol-1-yl)-phenyl]-(4-phenyl-4,5,6,7-tetrahydro-benzothiazol-2-yl)-amine (1172637-87-4)

Guidance literature:

Multi-step reaction with 2 steps

1: bromine / chloroform / 3 h / 20 °C

2: ethanol / Reflux

With bromine; In ethanol; chloroform;

DOI:10.1016/j.bmcl.2011.08.060

Reference yield:

1-(2-methoxy-4-nitrophenyl)-4-methyl-1H-imidazole (958245-17-5) → [3-methoxy-4-(4-methyl-imidazol-1-yl)-phenyl]-(4-phenyl-4,5,6,7-tetrahydro-benzothiazol-2-yl)-amine (1172637-87-4)

Guidance literature:

Multi-step reaction with 2 steps

1: palladium 10% on activated carbon; hydrogen / ethanol / 4 h / 20 °C / 760.05 Torr

2: ethanol / Reflux

With palladium 10% on activated carbon; hydrogen; In ethanol;

DOI:10.1016/j.bmcl.2011.08.060

Reference yield:

2-chloro-5-nitroanisole (1009-36-5) → [3-methoxy-4-(4-methyl-imidazol-1-yl)-phenyl]-(4-phenyl-4,5,6,7-tetrahydro-benzothiazol-2-yl)-amine (1172637-87-4)

Guidance literature:

Multi-step reaction with 3 steps

1: potassium hydroxide / dimethyl sulfoxide / 5 h / 80 °C

2: palladium 10% on activated carbon; hydrogen / ethanol / 4 h / 20 °C / 760.05 Torr

3: ethanol / Reflux

With palladium 10% on activated carbon; hydrogen; potassium hydroxide; In ethanol; dimethyl sulfoxide;

DOI:10.1016/j.bmcl.2011.08.060

upstream raw materials:

3-methoxy-4-(4-methyl-1H-imidazol-1-yl)aniline

1-(2-methoxy-4-nitrophenyl)-4-methyl-1H-imidazole

(RS)-2-phenylcyclohexanone

2-chloro-5-nitroanisole

Downstream raw materials:

2-(4-methyl-imidazol-1-yl)-5-(4-phenyl-4,5,6,7-tetrahydro-benzothiazol-2-ylamino)-phenol

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