2(3H)-Oxazolone, 5-(2-(4-(3-chlorophenyl)-1-piperazinyl)ethyl)-4-(4-fluorophenyl)-

Base Information

Chemical Name:2(3H)-Oxazolone, 5-(2-(4-(3-chlorophenyl)-1-piperazinyl)ethyl)-4-(4-fluorophenyl)-
CAS No.:120944-14-1
Molecular Formula:C21H21 Cl F N3 O2
Molecular Weight:401.8617
Hs Code.:
DSSTox Substance ID:DTXSID10153071
Wikidata:Q83019896
ChEMBL ID:CHEMBL439942
Mol file:120944-14-1.mol

Synonyms:BRN 6538998;2(3H)-Oxazolone, 5-(2-(4-(3-chlorophenyl)-1-piperazinyl)ethyl)-4-(4-fluorophenyl)-;5-(2-(4-(3-Chlorophenyl)-1-piperazinyl)ethyl)-4-(4-fluorophenyl)-2(3H)-oxazolone;120944-14-1;CHEMBL439942;DTXSID10153071;LS-100814

Suppliers and Price of 2(3H)-Oxazolone, 5-(2-(4-(3-chlorophenyl)-1-piperazinyl)ethyl)-4-(4-fluorophenyl)-

Supply Marketing:

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

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Chemical Property of 2(3H)-Oxazolone, 5-(2-(4-(3-chlorophenyl)-1-piperazinyl)ethyl)-4-(4-fluorophenyl)-

Chemical Property:

Density:1.303g/cm³
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:401.1306328
Heavy Atom Count:28
Complexity:586

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CN(CCN1CCC2=C(NC(=O)O2)C3=CC=C(C=C3)F)C4=CC(=CC=C4)Cl

Technology Process of 2(3H)-Oxazolone, 5-(2-(4-(3-chlorophenyl)-1-piperazinyl)ethyl)-4-(4-fluorophenyl)-

There total 2 articles about 2(3H)-Oxazolone, 5-(2-(4-(3-chlorophenyl)-1-piperazinyl)ethyl)-4-(4-fluorophenyl)- 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:

: 590-28-3
potassium cyanate

: 95217-30-4
4-[4-(3-Chloro-phenyl)-piperazin-1-yl]-1-(4-fluoro-phenyl)-2-hydroxy-butan-1-one

: 120944-14-1
5-{2-[4-(3-Chloro-phenyl)-piperazin-1-yl]-ethyl}-4-(4-fluoro-phenyl)-3H-oxazol-2-one

Guidance literature:: With hydrogenchloride; In N,N-dimethyl-formamide; at 60 ℃; for 0.25h;
DOI:10.1021/jm00130a003

Reference yield:

: 75-44-5
phosgene

: 95217-30-4
4-[4-(3-Chloro-phenyl)-piperazin-1-yl]-1-(4-fluoro-phenyl)-2-hydroxy-butan-1-one

: 120944-14-1
5-{2-[4-(3-Chloro-phenyl)-piperazin-1-yl]-ethyl}-4-(4-fluoro-phenyl)-3H-oxazol-2-one

Guidance literature:: With ammonia; triethylamine; Yield given. Multistep reaction; 1) CHCl₃, 0 deg C, 2 h, 2) 0 deg C to room temperature;
DOI:10.1021/jm00130a003