4-[4-(2-Oxo-1,2-dihydroquinolin-6-yl)piperazine-1-carbonyl]benzonitrile

Base Information

Chemical Name:4-[4-(2-Oxo-1,2-dihydroquinolin-6-yl)piperazine-1-carbonyl]benzonitrile
CAS No.:81839-76-1
Molecular Formula:C₂₁H₁₈N₄O₂
Molecular Weight:358.4
Hs Code.:
DSSTox Substance ID:DTXSID80530875
Wikidata:Q82402294

Synonyms:81839-76-1;SCHEMBL11205029;DTXSID80530875;4-[4-(2-Oxo-1,2-dihydroquinolin-6-yl)piperazine-1-carbonyl]benzonitrile

Suppliers and Price of 4-[4-(2-Oxo-1,2-dihydroquinolin-6-yl)piperazine-1-carbonyl]benzonitrile

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 1 raw suppliers

Chemical Property of 4-[4-(2-Oxo-1,2-dihydroquinolin-6-yl)piperazine-1-carbonyl]benzonitrile

Chemical Property:

XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:358.14297583
Heavy Atom Count:27
Complexity:650

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:C1CN(CCN1C2=CC3=C(C=C2)NC(=O)C=C3)C(=O)C4=CC=C(C=C4)C#N

Technology Process of 4-[4-(2-Oxo-1,2-dihydroquinolin-6-yl)piperazine-1-carbonyl]benzonitrile

There total 4 articles about 4-[4-(2-Oxo-1,2-dihydroquinolin-6-yl)piperazine-1-carbonyl]benzonitrile 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: 58.0%

: 6068-72-0
4-cyanobenzoyl chlorIde

: 86813-39-0
6-(1-piperazinyl)carbostyril hydrobromide

: 81839-76-1
6-[4-(4-Cyanobenzoyl)-1-piperazinyl]carbostyril

Guidance literature:: With triethylamine; In N,N-dimethyl-formamide; for 1h; Ambient temperature;
DOI:10.1248/cpb.32.2100

Reference yield:

: 43204-63-3
bis(2-bromoethyl)amine hydrobromide

: 81839-76-1
6-[4-(4-Cyanobenzoyl)-1-piperazinyl]carbostyril

Guidance literature:: Multi-step reaction with 2 steps

1: 2.) sodium carbonate / 1.) EtOH, reflux, 8 h; 2.) reflux, 8 h

2: 58 percent / triethylamine / dimethylformamide / 1 h / Ambient temperature

With sodium carbonate; triethylamine; In N,N-dimethyl-formamide;
DOI:10.1248/cpb.32.2100

Reference yield:

: 79207-68-4
6-amino-2(1H)-quinolinone

: 81839-76-1
6-[4-(4-Cyanobenzoyl)-1-piperazinyl]carbostyril

Guidance literature:: Multi-step reaction with 2 steps

1: 2.) sodium carbonate / 1.) EtOH, reflux, 8 h; 2.) reflux, 8 h

2: 58 percent / triethylamine / dimethylformamide / 1 h / Ambient temperature

With sodium carbonate; triethylamine; In N,N-dimethyl-formamide;
DOI:10.1248/cpb.32.2100