Pyrazino(1',2':1,6)pyrido(3,4-b)indole-2(1H)-butanol, 3,4,6,7,12,12a-hexahydro-alpha-(4-fluorophenyl)-alpha-phenyl-

Base Information

Chemical Name:Pyrazino(1',2':1,6)pyrido(3,4-b)indole-2(1H)-butanol, 3,4,6,7,12,12a-hexahydro-alpha-(4-fluorophenyl)-alpha-phenyl-
CAS No.:77294-00-9
Molecular Formula:C₃₀H₃₂FN₃O
Molecular Weight:469.602
Hs Code.:
DSSTox Substance ID:DTXSID40998538

Synonyms:BRN 4605522;77294-00-9;Pyrazino(1',2':1,6)pyrido(3,4-b)indole-2(1H)-butanol, 3,4,6,7,12,12a-hexahydro-alpha-(4-fluorophenyl)-alpha-phenyl-;C30H32FN3O;DTXSID40998538;C30-H32-F-N3-O;LS-127710;1-(4-Fluorophenyl)-4-(3,4,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-2(1H)-yl)-1-phenylbutan-1-ol

Suppliers and Price of Pyrazino(1',2':1,6)pyrido(3,4-b)indole-2(1H)-butanol, 3,4,6,7,12,12a-hexahydro-alpha-(4-fluorophenyl)-alpha-phenyl-

Supply Marketing:

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

Manufacturers and distributors:

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Total 2 raw suppliers

Chemical Property of Pyrazino(1',2':1,6)pyrido(3,4-b)indole-2(1H)-butanol, 3,4,6,7,12,12a-hexahydro-alpha-(4-fluorophenyl)-alpha-phenyl-

Chemical Property:

XLogP3:4.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:469.25294081
Heavy Atom Count:35
Complexity:693

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CN2CC3=C(CC2CN1CCCC(C4=CC=CC=C4)(C5=CC=C(C=C5)F)O)C6=CC=CC=C6N3

Technology Process of Pyrazino(1',2':1,6)pyrido(3,4-b)indole-2(1H)-butanol, 3,4,6,7,12,12a-hexahydro-alpha-(4-fluorophenyl)-alpha-phenyl-

There total 3 articles about Pyrazino(1',2':1,6)pyrido(3,4-b)indole-2(1H)-butanol, 3,4,6,7,12,12a-hexahydro-alpha-(4-fluorophenyl)-alpha-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: 33.4%

: 77294-14-5
δ-Hydroxy-δ-phenyl-δ-p-fluorophenylbutyl chloride

: 55344-28-0
1,2,3,4,6,7,12,12a-octahydropyrazino<2',1':6,1>pyrido<3,4-b>indole

: 77294-00-9
2-(δ-Phenyl-δ-p-fluorophenyl-δ-hydroxy)butyl-1,2,3,4,6,7,12,12a-octahydropyrazino<2',1':6,1>pyrido<3,4-b>indole

Guidance literature:: With sodium carbonate; sodium iodide; In N,N-dimethyl-formamide; at 75 ℃; for 40h;

Reference yield:

: 100-58-3
phenylmagnesium bromide

: 77294-00-9
2-(δ-Phenyl-δ-p-fluorophenyl-δ-hydroxy)butyl-1,2,3,4,6,7,12,12a-octahydropyrazino<2',1':6,1>pyrido<3,4-b>indole

Guidance literature:: Multi-step reaction with 2 steps

1: diethyl ether / Heating

2: 33.4 percent / Na₂CO₃, NaI / dimethylformamide / 40 h / 75 °C

With sodium carbonate; sodium iodide; In diethyl ether; N,N-dimethyl-formamide;

Reference yield:

: 3874-54-2,41167-07-1
4-(4-fluorophenyl)-4-oxo-n-butyl chloride

: 77294-00-9
2-(δ-Phenyl-δ-p-fluorophenyl-δ-hydroxy)butyl-1,2,3,4,6,7,12,12a-octahydropyrazino<2',1':6,1>pyrido<3,4-b>indole

Guidance literature:: Multi-step reaction with 2 steps

1: diethyl ether / Heating

2: 33.4 percent / Na₂CO₃, NaI / dimethylformamide / 40 h / 75 °C

With sodium carbonate; sodium iodide; In diethyl ether; N,N-dimethyl-formamide;