5-[4-(4-Nitrobenzoyl)piperazin-1-yl]-3,4-dihydroquinolin-2(1H)-one

Base Information

Chemical Name:5-[4-(4-Nitrobenzoyl)piperazin-1-yl]-3,4-dihydroquinolin-2(1H)-one
CAS No.:81839-35-2
Molecular Formula:C₂₀H₂₀N₄O₄
Molecular Weight:380.403
Hs Code.:
DSSTox Substance ID:DTXSID20530874
Wikidata:Q82402292

Synonyms:81839-35-2;SCHEMBL11195184;DTXSID20530874;5-[4-(4-Nitrobenzoyl)piperazin-1-yl]-3,4-dihydroquinolin-2(1H)-one

Suppliers and Price of 5-[4-(4-Nitrobenzoyl)piperazin-1-yl]-3,4-dihydroquinolin-2(1H)-one

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 5-[4-(4-Nitrobenzoyl)piperazin-1-yl]-3,4-dihydroquinolin-2(1H)-one

Chemical Property:

XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:380.14845513
Heavy Atom Count:28
Complexity:606

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CC(=O)NC2=C1C(=CC=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Technology Process of 5-[4-(4-Nitrobenzoyl)piperazin-1-yl]-3,4-dihydroquinolin-2(1H)-one

There total 4 articles about 5-[4-(4-Nitrobenzoyl)piperazin-1-yl]-3,4-dihydroquinolin-2(1H)-one 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: 57.0%

: 122-04-3
4-nitro-benzoyl chloride

: 81840-13-3
5-Piperazin-1-yl-3,4-dihydro-1H-quinolin-2-one; hydrochloride

: 81839-35-2
5-[4-(4-Nitrobenzoyl)-1-piperazinyl]-3,4-dihydrocarbostyril

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

: 81839-35-2
5-[4-(4-Nitrobenzoyl)-1-piperazinyl]-3,4-dihydrocarbostyril

Guidance literature:: Multi-step reaction with 2 steps

1: 2.) sodium carbonate; 3.) HCl / 1.) MeOH, reflux, 8 h; 2.) reflux, 8 h

2: 57 percent / triethylamine / dimethylformamide / 1 h / Ambient temperature

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

Reference yield:

: 58130-38-4
5-amino-3,4-dihydro-1H-quinolin-2-one

: 81839-35-2
5-[4-(4-Nitrobenzoyl)-1-piperazinyl]-3,4-dihydrocarbostyril

Guidance literature:: Multi-step reaction with 2 steps

1: 2.) sodium carbonate; 3.) HCl / 1.) MeOH, reflux, 8 h; 2.) reflux, 8 h

2: 57 percent / triethylamine / dimethylformamide / 1 h / Ambient temperature

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