2-Cyclopropyl-4-(4-fluorophenyl)-3-[(phenylthio)methyl]quinoline

Base Information

Chemical Name:2-Cyclopropyl-4-(4-fluorophenyl)-3-[(phenylthio)methyl]quinoline
CAS No.:148516-12-5
Molecular Formula:C₂₅H₂₀FNS
Molecular Weight:385.505
Hs Code.:
DSSTox Substance ID:DTXSID801170040

Synonyms:DTXSID801170040;148516-12-5;2-Cyclopropyl-4-(4-fluorophenyl)-3-[(phenylthio)methyl]quinoline

Suppliers and Price of 2-Cyclopropyl-4-(4-fluorophenyl)-3-[(phenylthio)methyl]quinoline

Supply Marketing:

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

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Chemical Property of 2-Cyclopropyl-4-(4-fluorophenyl)-3-[(phenylthio)methyl]quinoline

Chemical Property:

XLogP3:6.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:385.13004898
Heavy Atom Count:28
Complexity:495

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CC1C2=NC3=CC=CC=C3C(=C2CSC4=CC=CC=C4)C5=CC=C(C=C5)F

Technology Process of 2-Cyclopropyl-4-(4-fluorophenyl)-3-[(phenylthio)methyl]quinoline

There total 2 articles about 2-Cyclopropyl-4-(4-fluorophenyl)-3-[(phenylthio)methyl]quinoline 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:

: 148516-11-4
2-cyclopropyl-4-(4-fluoro-phenyl)-3-quinoline carboxylic acid ethyl ester

: 148516-12-5
2-Cyclopropyl-4-(4-fluoro-phenyl)-3-phenylsulfanylmethyl-quinoline

Guidance literature:: Multi-step reaction with 2 steps

1: lithium aluminum hydride / tetrahydrofuran / from 0 deg C to RT

2: tri-n-butylphosphine / pyridine / Ambient temperature

With lithium aluminium tetrahydride; tributylphosphine; In tetrahydrofuran; pyridine;
DOI:10.1016/S0957-4166(00)82337-X

Reference yield:

: 121660-11-5
2-cyclopropyl-4-(4-fluorophenyl)-3-(hydroxymethyl)quinoline

: 882-33-7
diphenyldisulfane

: 148516-12-5
2-Cyclopropyl-4-(4-fluoro-phenyl)-3-phenylsulfanylmethyl-quinoline

Guidance literature:: With tributylphosphine; In pyridine; Yield given; Ambient temperature;
DOI:10.1016/S0957-4166(00)82337-X

Reference yield:

: 148516-12-5
2-Cyclopropyl-4-(4-fluoro-phenyl)-3-phenylsulfanylmethyl-quinoline

: 148516-15-8
(6S)-6-{(E)-2-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]vinyl}-5,6-dihydro-2H-pyran-2-one

Guidance literature:: Multi-step reaction with 8 steps

1: 1.) tert-butyllithium / 1.) THF, 2.) THF, -78 deg C, 1 h

2: potassium hydroxide / tetrahydrofuran / 3.5 h / Ambient temperature

3: 100 percent / dimethylsulfoxide / 0.5 h / Ambient temperature

4: 67 percent / palladium(II) chloride, copper(II) chloride, NaOAc / 3 h / 760 Torr / Ambient temperature

5: H₂ / Lindlar cat. / methanol / 25 h / Ambient temperature

6: pyridinium p-toluenesulfonate (PPTS) / toluene / 1.5 h / Heating

7: m-chloroperbenzoic acid (m-CPBA) / CH₂Cl₂ / 1.) -78 deg C, 1 h, 2.) -40 deg C, 30 min

8: calcium carbonate / toluene / 0.5 h / Heating

With potassium hydroxide; hydrogen; tert.-butyl lithium; sodium acetate; pyridinium p-toluenesulfonate; 3-chloro-benzenecarboperoxoic acid; calcium carbonate; copper dichloride; palladium dichloride; Lindlar catalyst; In tetrahydrofuran; methanol; dichloromethane; dimethyl sulfoxide; toluene;
DOI:10.1016/S0957-4166(00)82337-X