1H-Imidazole, 5-(4-fluorophenyl)-1-[4-(methylthio)phenyl]-

Base Information

Chemical Name:1H-Imidazole, 5-(4-fluorophenyl)-1-[4-(methylthio)phenyl]-
CAS No.:578727-01-2
Molecular Formula:C16H13FN2S
Molecular Weight:284.35100
Hs Code.:
DSSTox Substance ID:DTXSID40447399
Wikidata:Q82266265

Synonyms:1H-Imidazole, 5-(4-fluorophenyl)-1-[4-(methylthio)phenyl]-;578727-01-2;DTXSID40447399

Suppliers and Price of 1H-Imidazole, 5-(4-fluorophenyl)-1-[4-(methylthio)phenyl]-

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

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Chemical Property of 1H-Imidazole, 5-(4-fluorophenyl)-1-[4-(methylthio)phenyl]-

Chemical Property:

PSA：43.12000
LogP:4.40030
XLogP3:3.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:284.07834776
Heavy Atom Count:20
Complexity:299

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CSC1=CC=C(C=C1)N2C=NC=C2C3=CC=C(C=C3)F

Technology Process of 1H-Imidazole, 5-(4-fluorophenyl)-1-[4-(methylthio)phenyl]-

There total 5 articles about 1H-Imidazole, 5-(4-fluorophenyl)-1-[4-(methylthio)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: 59.0%

: 87022-42-2
1-(isocyanomethyl)-1H-benzo[d][1,2,3]triazole

: N-(4-fluorobenzylidene)-4-methylthioaniline

: 578727-01-2
5-(4-fluorophenyl)-1-(4-methylthiophenyl)-1H-imidazole

Guidance literature:: With potassium tert-butylate; dimethyl sulfoxide; at 75 ℃;
DOI:10.1021/jm030765s

Reference yield: 9.0%

: 352-34-1
4-fluoro-1-iodobenzene

: 190198-32-4
1-(4-methylsulfanylphenyl)-1H-imidazole

: 2-(4-fluoro-phenyl)-1-(4-methylsulfanyl-phenyl)-1H-imidazole

: 2,5-bis-(4-fluoro-phenyl)-1-(4-methylsulfanyl-phenyl)-1H-imidazole

: 578727-01-2
5-(4-fluorophenyl)-1-(4-methylthiophenyl)-1H-imidazole

Guidance literature:: With triphenyl-arsane; cesium fluoride; palladium diacetate; In N,N-dimethyl-formamide; at 140 ℃; for 116h;
DOI:10.1021/jo050274a

Reference yield:

: 104-95-0
(4-bromophenyl)thioanisole

: 578727-01-2
5-(4-fluorophenyl)-1-(4-methylthiophenyl)-1H-imidazole

Guidance literature:: Multi-step reaction with 2 steps

1: 96 percent / 1,10-phenanthroline; trans,trans-dibenzylidene acetone; Cs₂CO₃ / copper(I) trifluoromethanesulfonate toluene complex / xylene / 110 °C

2: 9 percent / CsF; AsPh₃ / Pd(OAc)2 / dimethylformamide / 116 h / 140 °C

With 1,10-Phenanthroline; triphenyl-arsane; caesium carbonate; 1,5-diphenyl-1,4-pentadiene-3-one; cesium fluoride; palladium diacetate; copper(I) trifluoromethanesulfonate toluene adduct (1/1); In N,N-dimethyl-formamide; xylene;
DOI:10.1021/jo050274a