N-[2-(2-benzamidoethyldisulfanyl)ethyl]benzamide

Base Information

• Chemical Name: N-[2-(2-benzamidoethyldisulfanyl)ethyl]benzamide
• CAS No.: 5205-42-5
• Molecular Formula: C18H20N2O2S2
• Molecular Weight: 360.501
• NSC Number: 111222
• DSSTox Substance ID: DTXSID20296726
• Nikkaji Number: J1.268.067H
• Wikidata: Q82037445
• ChEMBL ID: CHEMBL270656
• Mol file: 5205-42-5.mol

Synonyms:MLS002706399;5205-42-5;NSC 111222;NSC111222;N,N'-Dibenzoylcystamin;CHEMBL270656;SCHEMBL10484573;DTXSID20296726;N,N'-(Dithiobisethylene)bisbenzamide;NSC-111222;SMR001573807

Chemical Property of N-[2-(2-benzamidoethyldisulfanyl)ethyl]benzamide

Chemical Property:

• XLogP3: 2.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 360.09662023
• Heavy Atom Count: 24
• Complexity: 345

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(=O)NCCSSCCNC(=O)C2=CC=CC=C2

Technology Process of N-[2-(2-benzamidoethyldisulfanyl)ethyl]benzamide

There total 12 articles about N-[2-(2-benzamidoethyldisulfanyl)ethyl]benzamide 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%

cystamine dihydrochioride (56-17-7) + benzoyl chloride (98-88-4) → N,N'-(2,2'-disulfanediylbis(ethane-2,1-diyl))dibenzamide (5205-42-5)

Guidance literature:

With triethylamine; In dichloromethane; at 0 - 20 ℃; for 20h; Inert atmosphere;

DOI:10.1002/cmdc.201200450

Reference yield: 80.0%

2,2'-dithio-bis[ethylamine] (51-85-4) + benzoyl chloride (98-88-4) → N,N'-(2,2'-disulfanediylbis(ethane-2,1-diyl))dibenzamide (5205-42-5)

Guidance literature:

With triethylamine; In dichloromethane;

DOI:10.1016/j.bmcl.2007.10.112

Reference yield: 77.0%

N-[2-(Quinolin-2-ylmethylsulfanyl)-ethyl]-benzamide → N,N'-(2,2'-disulfanediylbis(ethane-2,1-diyl))dibenzamide (5205-42-5)

Guidance literature:

With iron(III) chloride; In ethanol; water; for 24h; Heating;

DOI:10.1246/cl.1993.803

upstream raw materials:

N-(2-hydroxyethyl)-benzamide

N-(2-thiocyanato-ethyl)-benzamide

2-aminoethylthiosulfonic acid

benzoyl chloride

Downstream raw materials:

2-phenylthiazoline

2,2'-dithio-bis[ethylamine]

N-(2-Sulfanylethyl)benzamide

bis-(2-benzylamino-ethyl)-disulfide

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