2-Amino-5-(methylthio)benzamide

Base Information

• Chemical Name: 2-Amino-5-(methylthio)benzamide
• CAS No.: 119023-26-6
• Molecular Formula: C₈H₁₀N₂OS
• Molecular Weight: 182.246
• DSSTox Substance ID: DTXSID301303488
• Mol file: 119023-26-6.mol

Synonyms:2-amino-5-(methylthio)benzamide;119023-26-6;SCHEMBL9770537;DTXSID301303488;AKOS010561775

Chemical Property of 2-Amino-5-(methylthio)benzamide

Chemical Property:

• XLogP3: 0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 182.05138412
• Heavy Atom Count: 12
• Complexity: 174

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CSC1=CC(=C(C=C1)N)C(=O)N

Technology Process of 2-Amino-5-(methylthio)benzamide

There total 1 articles about 2-Amino-5-(methylthio)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:

2-nitro-5-chlorobenzamide (40763-96-0) + dimethyl sulfate (77-78-1) → 2-amino-5-methylthiobenzamide (119023-26-6)

Guidance literature:

With sodium sulfide; sodium hydroxide; Yield given. Multistep reaction; 1.) water, MeOH, 50 deg C, 5 min, 2.) reflux, 2 h;

DOI:10.1248/cpb.36.2955

Reference yield:

2-amino-5-methylthiobenzamide (119023-26-6) + C19H27NO5 → 6-Methylsulfanyl-2-[3-(3-piperidin-1-ylmethyl-phenoxy)-propyl]-3H-quinazolin-4-one (105189-29-5)

Guidance literature:

With sodium hydroxide; Yield given. Multistep reaction; 1.) THF, reflux, 1 h, 2.) THF, MeOH, reflux, 0.5 h;

DOI:10.1248/cpb.36.2955

upstream raw materials:

2-nitro-5-chlorobenzamide

dimethyl sulfate

Downstream raw materials:

6-Methylsulfanyl-2-[3-(3-piperidin-1-ylmethyl-phenoxy)-propyl]-3H-quinazolin-4-one