N-(((4-Chlorophenyl)amino)carbonyl)benzamide

Base Information

• Chemical Name: N-(((4-Chlorophenyl)amino)carbonyl)benzamide
• CAS No.: 57160-48-2
• Molecular Formula: C14H10ClFN2O2
• Molecular Weight: 292.697
• Hs Code.: 2924299090
• NSC Number: 287044
• DSSTox Substance ID: DTXSID10972623
• Wikidata: Q82956412
• Mol file: 57160-48-2.mol

Synonyms:N-(((4-Chlorophenyl)amino)carbonyl)benzamide;57160-48-2;Benzamide, N-(((4-chlorophenyl)amino)carbonyl)-;NSC 287044;NSC287044;C14H10ClN2O2;DTXSID10972623;C14-H10-Cl-N2-O2;NSC-287044;N-[(4-Chlorophenyl)carbamoyl]-2-fluorobenzene-1-carboximidic acid

Chemical Property of N-(((4-Chlorophenyl)amino)carbonyl)benzamide

Chemical Property:

• PSA: 58.20000
• Density: 1.414g/cm³
• LogP: 3.90490
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 292.0414834
• Heavy Atom Count: 20
• Complexity: 359

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)NC(=O)NC2=CC=C(C=C2)Cl)F
• Use Description: N-[(4-chlorophenyl)carbamoyl]-2-fluorobenzamide, a specific chemical compound, serves varied functions across diverse fields. In the pharmaceutical sector, it plays a crucial role as a potential scaffold in drug discovery, contributing to the development of novel therapeutic agents due to its structural features. In organic synthesis, this compound acts as a versatile building block, enabling the creation of complex molecular structures for medicinal and chemical research purposes. Additionally, in the field of agrochemicals, it may contribute to the formulation of pesticides, aiding in pest management and crop protection. The compound's multifaceted applications in pharmaceuticals, chemistry, and agriculture underline its significance in driving innovation, scientific exploration, and practical solutions across these vital domains.

Technology Process of N-(((4-Chlorophenyl)amino)carbonyl)benzamide

There total 2 articles about N-(((4-Chlorophenyl)amino)carbonyl)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: 80.0%

2-fluorobenzamide (445-28-3) + p-chlorphenylisocyanate (104-12-1) → 1-(2-fluorobenzoyl)-3-(4-chlorophenyl)urea (57160-48-2)

Guidance literature:

In toluene; for 5h; Heating;

Reference yield:

→ 1-(2-fluorobenzoyl)-3-(4-chlorophenyl)urea (57160-48-2)

Guidance literature:

Entspr. Benzamid, entspr. Phenylisocyanat;

DOI:10.1021/jf60203a018

Reference yield:

1-(2-fluorobenzoyl)-3-(4-chlorophenyl)urea (57160-48-2) + sodium methylate (124-41-4) → methyl 2-fluorobenzoate (394-35-4) + N-(4-chlorophenyl)urea (140-38-5)

Guidance literature:

In methanol; at 25 ℃; Kinetics; Mechanism; Rate constant;

upstream raw materials:

2-fluorobenzamide

p-chlorphenylisocyanate

Downstream raw materials:

methyl 2-fluorobenzoate

N-(4-chlorophenyl)urea

Refernces