(1,1-Dimethylethyl)carbamic acid 1-(4-fluorobenzoyl)-3-(4-phenyl-1-piperazinyl)propyl ester

Base Information

Chemical Name:(1,1-Dimethylethyl)carbamic acid 1-(4-fluorobenzoyl)-3-(4-phenyl-1-piperazinyl)propyl ester
CAS No.:51037-68-4
Molecular Formula:C₂₅H₃₂FN₃O₃
Molecular Weight:441.546
Hs Code.:
DSSTox Substance ID:DTXSID20965324
ChEMBL ID:CHEMBL167199

Synonyms:BRN 0865114;(1,1-Dimethylethyl)carbamic acid 1-(4-fluorobenzoyl)-3-(4-phenyl-1-piperazinyl)propyl ester;51037-68-4;Carbamic acid, (1,1-dimethylethyl)-, 1-(4-fluorobenzoyl)-3-(4-phenyl-1-piperazinyl)propyl ester;CHEMBL167199;SCHEMBL11841214;C25H32FN3O3;DTXSID20965324;C25-H32-F-N3-O3;LS-49561;1-(4-Fluorophenyl)-1-oxo-4-(4-phenylpiperazin-1-yl)butan-2-yl hydrogen tert-butylcarbonimidate

Suppliers and Price of (1,1-Dimethylethyl)carbamic acid 1-(4-fluorobenzoyl)-3-(4-phenyl-1-piperazinyl)propyl ester

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of (1,1-Dimethylethyl)carbamic acid 1-(4-fluorobenzoyl)-3-(4-phenyl-1-piperazinyl)propyl ester

Chemical Property:

Vapor Pressure:3.56E-14mmHg at 25°C
Boiling Point:596.1°C at 760 mmHg
Flash Point:314.3°C
Density:1.155g/cm³
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:441.24277005
Heavy Atom Count:32
Complexity:602

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)NC(=O)OC(CCN1CCN(CC1)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)F

Technology Process of (1,1-Dimethylethyl)carbamic acid 1-(4-fluorobenzoyl)-3-(4-phenyl-1-piperazinyl)propyl ester

There total 3 articles about (1,1-Dimethylethyl)carbamic acid 1-(4-fluorobenzoyl)-3-(4-phenyl-1-piperazinyl)propyl ester 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:

: 51037-47-9
1-(4-fluorophenyl)-2-hydroxy-4-(4-phenyl-1-piperazinyl)-1-butanone

: 51037-68-4
tert-Butyl-carbamic acid 1-(4-fluoro-benzoyl)-3-(4-phenyl-piperazin-1-yl)-propyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: Et₃N / toluene; CHCl₃ / 5.5 h / 0 - 20 °C

2: Et₃N / toluene; CHCl₃ / 2 h / Ambient temperature

With triethylamine; In chloroform; toluene;
DOI:10.1021/jm00383a021