Acetamide, N-(4-((3-(1,3,4,6,11,11a-hexahydro-2H-pyrazino(1,2-b)isoquinolin-2-yl)propyl)sulfonyl)phenyl)-

Base Information

Chemical Name:Acetamide, N-(4-((3-(1,3,4,6,11,11a-hexahydro-2H-pyrazino(1,2-b)isoquinolin-2-yl)propyl)sulfonyl)phenyl)-
CAS No.:115041-56-0
Molecular Formula:C23H29 N3 O3 S
Molecular Weight:427.5597
Hs Code.:
DSSTox Substance ID:DTXSID70921596
Mol file:115041-56-0.mol

Synonyms:BRN 5166605;115041-56-0;Acetamide, N-(4-((3-(1,3,4,6,11,11a-hexahydro-2H-pyrazino(1,2-b)isoquinolin-2-yl)propyl)sulfonyl)phenyl)-;C23H29N3O3S;DTXSID70921596;C23-H29-N3-O3-S;LS-9669;N-{4-[3-(1,3,4,6,11,11a-Hexahydro-2H-pyrazino[1,2-b]isoquinolin-2-yl)propane-1-sulfonyl]phenyl}ethanimidic acid

Suppliers and Price of Acetamide, N-(4-((3-(1,3,4,6,11,11a-hexahydro-2H-pyrazino(1,2-b)isoquinolin-2-yl)propyl)sulfonyl)phenyl)-

Supply Marketing:

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

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Chemical Property of Acetamide, N-(4-((3-(1,3,4,6,11,11a-hexahydro-2H-pyrazino(1,2-b)isoquinolin-2-yl)propyl)sulfonyl)phenyl)-

Chemical Property:

Vapor Pressure:1.16E-18mmHg at 25°C
Boiling Point:685.9°Cat760mmHg
Flash Point:368.6°C
Density:1.3g/cm³
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:427.19296297
Heavy Atom Count:30
Complexity:684

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)NC1=CC=C(C=C1)S(=O)(=O)CCCN2CCN3CC4=CC=CC=C4CC3C2

Technology Process of Acetamide, N-(4-((3-(1,3,4,6,11,11a-hexahydro-2H-pyrazino(1,2-b)isoquinolin-2-yl)propyl)sulfonyl)phenyl)-

There total 2 articles about Acetamide, N-(4-((3-(1,3,4,6,11,11a-hexahydro-2H-pyrazino(1,2-b)isoquinolin-2-yl)propyl)sulfonyl)phenyl)- 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: 66.0%

: 78234-18-1
γ-chloropropyl 4-acetamidophenyl sulphone

: 50290-83-0
1,3,4,6,11,11a-hexahydro-2H-pyrazino[1,2-b]isoquinoline

: 115041-56-0
1-(1,3,4,6,11,11a-hexahydro-2H-pyrazino<1,2-b>isoquinolin-2-yl)-3-(4-aminophenylsulphono)propane

Guidance literature:: With sodium carbonate; sodium iodide; In N,N-dimethyl-formamide; at 80 ℃;

Reference yield:

: 1126-81-4
4-acetamidothiophenol

: 115041-56-0
1-(1,3,4,6,11,11a-hexahydro-2H-pyrazino<1,2-b>isoquinolin-2-yl)-3-(4-aminophenylsulphono)propane

Guidance literature:: Multi-step reaction with 3 steps

1: 50 percent / NaOH (aq.) / ethanol / 2 h / 100 °C

2: 90 percent / 1) KMnO₄, 2) H₂O₂ / aq. acetic acid / 1) 30 deg C, 4 h

3: 66 percent / NaI, Na₂CO₃ / dimethylformamide / 80 °C

With sodium hydroxide; potassium permanganate; dihydrogen peroxide; sodium carbonate; sodium iodide; In ethanol; acetic acid; N,N-dimethyl-formamide;