2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R,S)-

Base Information

Chemical Name:2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)-
CAS No.:132634-48-1
Molecular Formula:C₂₁H₂₃ClFN₃O₃
Molecular Weight:419.883
Hs Code.:
DSSTox Substance ID:DTXSID20157681
Wikidata:Q76279343

Synonyms:132634-48-1;2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)-;DTXSID20157681;C21-H23-Cl-F-N3-O3;LS-42361

Suppliers and Price of 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)-

Supply Marketing:

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

Manufacturers and distributors:

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Total 0 raw suppliers

Chemical Property of 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)-

Chemical Property:

Vapor Pressure:1.98E-14mmHg at 25°C
Boiling Point:582.9°C at 760 mmHg
Flash Point:306.3°C
Density:1.364g/cm³
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:419.1411975
Heavy Atom Count:29
Complexity:584

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C(C1=CC2=C(C=C1Cl)N(C(=O)O2)C)O)N3CCN(CC3)C4=CC=C(C=C4)F
Isomeric SMILES:C[C@@H]([C@@H](C1=CC2=C(C=C1Cl)N(C(=O)O2)C)O)N3CCN(CC3)C4=CC=C(C=C4)F

Technology Process of 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)-

There total 8 articles about 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)- 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: 73.0%

: 5-Chloro-6-{2-[4-(4-fluoro-phenyl)-piperazin-1-yl]-propionyl}-3-methyl-3H-benzooxazol-2-one

: 132634-47-0,132634-48-1
5-Chloro-6-{2-[4-(4-fluoro-phenyl)-piperazin-1-yl]-1-hydroxy-propyl}-3-methyl-3H-benzooxazol-2-one

: 132634-47-0,132634-48-1
5-Chloro-6-{2-[4-(4-fluoro-phenyl)-piperazin-1-yl]-1-hydroxy-propyl}-3-methyl-3H-benzooxazol-2-one

Guidance literature:: With sodium tetrahydroborate; In methanol; for 4h; Yields of byproduct given; reduced pressure;

Reference yield: 73.0%

: 5-Chloro-6-{2-[4-(4-fluoro-phenyl)-piperazin-1-yl]-propionyl}-3-methyl-3H-benzooxazol-2-one

: 132634-47-0,132634-48-1
5-Chloro-6-{2-[4-(4-fluoro-phenyl)-piperazin-1-yl]-1-hydroxy-propyl}-3-methyl-3H-benzooxazol-2-one

: 132634-47-0,132634-48-1
5-Chloro-6-{2-[4-(4-fluoro-phenyl)-piperazin-1-yl]-1-hydroxy-propyl}-3-methyl-3H-benzooxazol-2-one

Guidance literature:: With sodium tetrahydroborate; In methanol; for 4h; Yields of byproduct given; reduced pressure;

Reference yield:

: 5790-90-9
5-chloro-3-methyl-1,3-benzoxazol-2(3H)-one

: 132634-47-0,132634-48-1
5-Chloro-6-{2-[4-(4-fluoro-phenyl)-piperazin-1-yl]-1-hydroxy-propyl}-3-methyl-3H-benzooxazol-2-one

Guidance literature:: Multi-step reaction with 3 steps

1: polyphosphoric acid / 110 °C

2: triethylamine / dioxane / 30 h / Ambient temperature

3: 73 percent / NaBH₄ / methanol / 4 h / reduced pressure

With sodium tetrahydroborate; PPA; triethylamine; In 1,4-dioxane; methanol;