2(1H)-Quinolinone, 3,4-dihydro-6-(1-oxo-4-(4-phenyl-1-piperazinyl)butyl)-, monohydrochloride

Base Information

• Chemical Name: 2(1H)-Quinolinone, 3,4-dihydro-6-(1-oxo-4-(4-phenyl-1-piperazinyl)butyl)-, monohydrochloride
• CAS No.: 80834-49-7
• Molecular Formula: C₂₃H₂₇N₃O₂*ClH
• Molecular Weight: 413.947
• DSSTox Substance ID: DTXSID00230648
• Mol file: 80834-49-7.mol

Synonyms:6-(1-Oxo-4-(4-phenyl-1-piperazinyl)butyl)-3,4-dihydrocarbostyril monohydrochloride;2(1H)-Quinolinone, 3,4-dihydro-6-(1-oxo-4-(4-phenyl-1-piperazinyl)butyl)-, monohydrochloride;6-(1-oxo-4-(4-phenyl-1-piperazinyl)butyl)-3,4-dihydro-2(1H)-quinolinone monohydrochloride;80834-49-7;6-[1-oxo-4-(4-phenyl-1-piperazinyl)butyl]-3,4-dihydrocarbostyril monohydrochloride;SCHEMBL10837432;DTXSID00230648;UGXQXPCRCROLAX-UHFFFAOYSA-N;LS-142759

Chemical Property of 2(1H)-Quinolinone, 3,4-dihydro-6-(1-oxo-4-(4-phenyl-1-piperazinyl)butyl)-, monohydrochloride

Chemical Property:

• Vapor Pressure: 1.27E-15mmHg at 25°C
• Boiling Point: 626.7°C at 760 mmHg
• Flash Point: 332.8°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 413.1870048
• Heavy Atom Count: 29
• Complexity: 538

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(=O)NC2=C1C=C(C=C2)C(=O)CCCN3CCN(CC3)C4=CC=CC=C4.Cl

Technology Process of 2(1H)-Quinolinone, 3,4-dihydro-6-(1-oxo-4-(4-phenyl-1-piperazinyl)butyl)-, monohydrochloride

There total 3 articles about 2(1H)-Quinolinone, 3,4-dihydro-6-(1-oxo-4-(4-phenyl-1-piperazinyl)butyl)-, monohydrochloride 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:

6-{1-oxo-4-[di-(2-chloroethyl)amino]-butyl}-3,4-dihydrocarbostyril (80835-67-2) → 6-[1-oxo-4-(4-phenyl-1-piperazinyl)butyl]-3,4-dihydrocarbostyril monohydrochloride (80834-49-7)

Guidance literature:

With hydrogenchloride; potassium carbonate; aniline; In ethanol;

Reference yield:

4-phenyl-1-piperazine (92-54-6) + 5%-sodium hydrogencarbonate + 6-(4-chloro-1-oxobutyl)-3,4-dihydrocarbostyril (80834-82-8) + sodium iodide (7681-82-5,24359-64-6,41927-88-2,115813-40-6) → 6-[1-oxo-4-(4-phenyl-1-piperazinyl)butyl]-3,4-dihydrocarbostyril monohydrochloride (80834-49-7)

Guidance literature:

With hydrogenchloride; triethylamine; In N-methyl-acetamide; methanol; chloroform; acetone;

Reference yield:

→ 6-[1-oxo-4-(4-phenyl-1-piperazinyl)butyl]-3,4-dihydrocarbostyril monohydrochloride (80834-49-7)

Guidance literature:

upstream raw materials:

4-phenyl-1-piperazine

6-(4-chloro-1-oxobutyl)-3,4-dihydrocarbostyril

sodium iodide

6-{1-oxo-4-[di-(2-chloroethyl)amino]-butyl}-3,4-dihydrocarbostyril