2-[(4-Methylbenzoyl)amino]benzamide

Base Information

• Chemical Name: 2-[(4-Methylbenzoyl)amino]benzamide
• CAS No.: 52910-88-0
• Molecular Formula: C15H14N2O2
• Molecular Weight: 254.288
• DSSTox Substance ID: DTXSID10356106
• Nikkaji Number: J1.743.640F
• Wikidata: Q82135271
• ChEMBL ID: CHEMBL3827595
• Mol file: 52910-88-0.mol

Synonyms:2-[(4-methylbenzoyl)amino]benzamide;52910-88-0;2-(4-methylbenzamido)benzamide;2'-carbamoyl-p-toluanilide;N-(2-carbamoylphenyl)-4-methylbenzamide;Oprea1_498119;Oprea1_537472;CHEMBL3827595;SCHEMBL11079536;DTXSID10356106;PLOYCGFJCRPJIW-UHFFFAOYSA-N;STK161094;AKOS000604284;Z57372972

Chemical Property of 2-[(4-Methylbenzoyl)amino]benzamide

Chemical Property:

• PSA: 73.18000
• LogP: 3.30340
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 254.105527694
• Heavy Atom Count: 19
• Complexity: 335

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)N

Technology Process of 2-[(4-Methylbenzoyl)amino]benzamide

There total 8 articles about 2-[(4-Methylbenzoyl)amino]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%

4-methyl-benzoyl chloride (874-60-2) + anthranilic acid amide (28144-70-9,88-68-6) → N-(2-carbamoylphenyl)-4-methylbenzamide (52910-88-0)

Guidance literature:

With pyridine; In tetrahydrofuran; for 16h; Inert atmosphere;

DOI:10.1016/j.ejmech.2016.04.041

Reference yield: 93.0%

2-(4-methylbenzamido)-N-(quinolin-8-yl)benzamide → N-(2-carbamoylphenyl)-4-methylbenzamide (52910-88-0)

Guidance literature:

With 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione; In water; at 60 ℃; for 2h; chemoselective reaction;

DOI:10.1021/acs.joc.9b01362

Reference yield:

2-(4-methylphenyl)-4H-3,1-benzoxazin-4-one (18600-54-9) → N-(2-carbamoylphenyl)-4-methylbenzamide (52910-88-0)

Guidance literature:

With ethanol; ammonia;

DOI:10.1021/jo01158a006

upstream raw materials:

2-(4-methylphenyl)-4H-3,1-benzoxazin-4-one

methyl 2-(4-methylbenzamido)benzoate

N-(2-cyanophenyl)-4-methylbenzamide

4-methyl-benzoyl chloride

Downstream raw materials:

2-(4-methylphenyl)-4(3H)-quinazolinone