n-{4-[(5-Butyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}acetamide

Base Information

• Chemical Name: n-{4-[(5-Butyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}acetamide
• CAS No.: 6314-71-2
• Molecular Formula: C₁₄H₁₈N₄O₃S₂
• Molecular Weight: 354.454
• NSC Number: 23006
• DSSTox Substance ID: DTXSID40281770
• Wikidata: Q82015838
• Mol file: 6314-71-2.mol

Synonyms:6314-71-2;n-{4-[(5-butyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}acetamide;NSC23006;SCHEMBL10108459;DTXSID40281770;NSC 23006;NSC-23006

Chemical Property of n-{4-[(5-Butyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}acetamide

Chemical Property:

• PSA: 137.67000
• Density: 1.398g/cm³
• LogP: 3.86670
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 354.08203280
• Heavy Atom Count: 23
• Complexity: 487

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

Technology Process of n-{4-[(5-Butyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}acetamide

There total 2 articles about n-{4-[(5-Butyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}acetamide 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:

N-(butyl-[1,3,4]thiadiazol-2-yl)-valeramide (104110-41-0) → N-acetyl-sulfanilic acid-(5-butyl-[1,3,4]thiadiazol-2-ylamide) (6314-71-2)

Guidance literature:

Multi-step reaction with 2 steps

1: aqueous NaOH

2: pyridine

With pyridine; sodium hydroxide;

DOI:10.1002/ardp.19512840202

Reference yield:

5-butyl-[1,3,4]thiadiazol-2-ylamine (14068-54-3) + p-acetylaminobenzenesulfonyl chloride (121-60-8) → N-acetyl-sulfanilic acid-(5-butyl-[1,3,4]thiadiazol-2-ylamide) (6314-71-2)

Guidance literature:

With pyridine;

DOI:10.1002/ardp.19512840202

upstream raw materials:

5-butyl-[1,3,4]thiadiazol-2-ylamine

p-acetylaminobenzenesulfonyl chloride

N-(butyl-[1,3,4]thiadiazol-2-yl)-valeramide