1-(2,4-dichlorobenzyl)-2-methyl-N-(pentylsulfonyl)-1H-benzo[d]imidazole-6-carboxamide

Base Information

• Chemical Name: 1-(2,4-dichlorobenzyl)-2-methyl-N-(pentylsulfonyl)-1H-benzo[d]imidazole-6-carboxamide
• CAS No.: 193012-35-0
• Deprecated CAS: 400608-02-8
• Molecular Formula: C21H23Cl2N3O3S
• Molecular Weight: 468.404
• UNII: V5Q32BZX79
• DSSTox Substance ID: DTXSID60940978
• Nikkaji Number: J2.256.331I
• Wikidata: Q27291562
• Metabolomics Workbench ID: 153525
• ChEMBL ID: CHEMBL3545278
• Mol file: 193012-35-0.mol

Synonyms:3-(2,4-dichlorobenzyl)-2-methyl-N-(pentylsulfonyl)-3 H-benzimidazole-5-carboxamide;FK614 cpd

Chemical Property of 1-(2,4-dichlorobenzyl)-2-methyl-N-(pentylsulfonyl)-1H-benzo[d]imidazole-6-carboxamide

Chemical Property:

• XLogP3: 5.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 467.0837182
• Heavy Atom Count: 30
• Complexity: 688

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCS(=O)(=O)NC(=O)C1=CC2=C(C=C1)N=C(N2CC3=C(C=C(C=C3)Cl)Cl)C
• Recent ClinicalTrials: Trial of FK614 in Type 2 Diabetics Inadequately Controlled on a Sulfonylurea

Technology Process of 1-(2,4-dichlorobenzyl)-2-methyl-N-(pentylsulfonyl)-1H-benzo[d]imidazole-6-carboxamide

There total 3 articles about 1-(2,4-dichlorobenzyl)-2-methyl-N-(pentylsulfonyl)-1H-benzo[d]imidazole-6-carboxamide 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:

6-carboxy-1-(2,4-dichlorobenzyl)-2-methylbenzimidazole> (193010-16-1) + 1-pentylsulfonamide (52960-14-2) + 1,8-diazabicyclo[5.4.0]undec-7-ene (6674-22-2,83329-50-4) + 1,1'-carbonyldiimidazole (530-62-1) → FK614 (193012-35-0)

Guidance literature:

With hydrogenchloride; In methanol; water; N,N-dimethyl-formamide;

Reference yield:

6-carboxy-1-(2,4-dichlorobenzyl)-2-methylbenzimidazole> (193010-16-1) + 1-pentylsulfonamide (52960-14-2) → FK614 (193012-35-0)

Guidance literature:

With diaza-bicyclo-undecene; 1,1'-carbonyldiimidazole;

Reference yield:

6-carboxy-1-(2,4-dichlorobenzyl)-2-methylbenzimidazole> (193010-16-1) + diaza-bicyclo-undecene + 1-pentylsulfonamide (52960-14-2) → FK614 (193012-35-0)

Guidance literature:

With 1,1'-carbonyldiimidazole;

upstream raw materials:

6-carboxy-1-(2,4-dichlorobenzyl)-2-methylbenzimidazole>

1-pentylsulfonamide

1,8-diazabicyclo[5.4.0]undec-7-ene

1,1'-carbonyldiimidazole

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