Ethanimidamide, N,N'-bis(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]-

Base Information

• Chemical Name: Ethanimidamide, N,N'-bis(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]-
• CAS No.: 89523-40-0
• Molecular Formula: C23H24N2O2S
• Molecular Weight: 392.522
• DSSTox Substance ID: DTXSID10391512
• Nikkaji Number: J338.197H
• Mol file: 89523-40-0.mol

Synonyms:Ethanimidamide, N,N'-bis(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]-;89523-40-0;DTXSID10391512

Chemical Property of Ethanimidamide, N,N'-bis(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]-

Chemical Property:

• XLogP3: 5.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 392.15584919
• Heavy Atom Count: 28
• Complexity: 616

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)N=C(C)N(C2=CC=C(C=C2)C)S(=O)(=O)C3=CC=C(C=C3)C

Technology Process of Ethanimidamide, N,N'-bis(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]-

There total 1 articles about Ethanimidamide, N,N'-bis(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]- 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: 77.0%

N1,N2-Di(p-methylphenyl)acetamidine (5132-17-2,119257-45-3,889130-94-3) + p-toluenesulfonyl chloride (98-59-9) → N1-Tosyl-N1,N2-di(p-methylphenyl)-acetamidine (89523-40-0)

Guidance literature:

With triethylamine; In benzene; for 48h; Ambient temperature;

Reference yield: 50.0%

N1-Tosyl-N1,N2-di(p-methylphenyl)-acetamidine (89523-40-0) + 4-chloro-aniline (106-47-8) → 4-methyl-N-(4-methylphenyl)benzenesulfonamide (599-86-0) + N-(4-Chloro-phenyl)-N'-p-tolyl-acetamidine (129957-39-7)

Guidance literature:

With n-butyllithium; In tetrahydrofuran; hexane; for 0.5h; Yields of byproduct given; Ambient temperature;

DOI:10.1248/cpb.38.1373

Reference yield:

4-Methyl-N-p-tolyl-N-{1-[(E)-p-tolylimino]-ethyl}-benzenesulfonamide (89523-40-0) + 2,4-Dinitroanilin (97-02-9) → 4-methyl-N-(4-methylphenyl)benzenesulfonamide (599-86-0) + N-(2,4-Dinitro-phenyl)-N'-p-tolyl-acetamidine (128915-25-3)

Guidance literature:

With (1,4,7,10-tetraoxacyclododecane); potassium tert-butylate; Multistep reaction. Yields of byproduct given; 1) THF, r.t., 30 min, 2) r.t., 1d;

DOI:10.1248/cpb.38.866

upstream raw materials:

N¹,N²-Di(p-methylphenyl)acetamidine

p-toluenesulfonyl chloride

Downstream raw materials:

N-tosyl-p-toluidine sodium salt

N¹-Tosyl-N¹-(p-methoxyphenyl)-N²-(p-methylphenyl)acetamidine

4-methyl-N-(4-methylphenyl)benzenesulfonamide

N-(4-Chloro-phenyl)-N'-p-tolyl-acetamidine

Refernces