2(1H)-Quinolinone, 4-(5-chloro-2-hydroxyphenyl)-3-(2-hydroxyethyl)-6-(trifluoromethyl)-

Base Information

• Chemical Name: 2(1H)-Quinolinone, 4-(5-chloro-2-hydroxyphenyl)-3-(2-hydroxyethyl)-6-(trifluoromethyl)-
• CAS No.: 275375-69-4
• Molecular Formula: C₁₈H₁₃ClF₃NO₃
• Molecular Weight: 383.754
• UNII: 889F719S7K
• Nikkaji Number: J1.896.385J
• ChEMBL ID: CHEMBL222460
• Mol file: 275375-69-4.mol

Synonyms:4-(5-chloro-2-hydroxyphenyl)-3-(2-hydroxyethyl)-6-(trifluoromethyl)-quinolin-2(1H)-one;BMS 223131;BMS-223131;BMS223131

Chemical Property of 2(1H)-Quinolinone, 4-(5-chloro-2-hydroxyphenyl)-3-(2-hydroxyethyl)-6-(trifluoromethyl)-

Chemical Property:

• XLogP3: 3.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 383.0536055
• Heavy Atom Count: 26
• Complexity: 581

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC2=C(C=C1C(F)(F)F)C(=C(C(=O)N2)CCO)C3=C(C=CC(=C3)Cl)O

Technology Process of 2(1H)-Quinolinone, 4-(5-chloro-2-hydroxyphenyl)-3-(2-hydroxyethyl)-6-(trifluoromethyl)-

There total 10 articles about 2(1H)-Quinolinone, 4-(5-chloro-2-hydroxyphenyl)-3-(2-hydroxyethyl)-6-(trifluoromethyl)- 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: 30.0%

4-(4'-trifluoromethylphenylcarboxamide)-5-(2-hydroxy-5-chloro)-2,3-dihydrofuran → 4-(5-chloro-2-hydroxyphenyl)-3-(2-hydroxyethyl)-6-(trifluoromethyl)-2(1H)-quinolinone (275375-69-4,722497-38-3,722497-39-4)

Guidance literature:

In methanol; at 30 - 40 ℃; Irradiation;

Reference yield: 30.0%

→ 4-(5-chloro-2-hydroxyphenyl)-3-(2-hydroxyethyl)-6-(trifluoromethyl)-2(1H)-quinolinone (275375-69-4,722497-38-3,722497-39-4)

Guidance literature:

Reference yield:

[4-(5-chloro-2-hydroxy-phenyl)-2-oxo-6-trifluoromethyl-1,2-dihydro-quinolin-3-yl]-acetic acid (275376-03-9) → 4-(5-chloro-2-hydroxyphenyl)-3-(2-hydroxyethyl)-6-(trifluoromethyl)-2(1H)-quinolinone (275375-69-4,722497-38-3,722497-39-4)

Guidance literature:

With dimethylsulfide borane complex; In tetrahydrofuran; at 0 - 23 ℃;

DOI:10.1021/jm030005h

upstream raw materials:

[4-(5-chloro-2-hydroxy-phenyl)-2-oxo-6-trifluoromethyl-1,2-dihydro-quinolin-3-yl]-acetic acid

4-(2-benzyloxy-5-chloro-phenyl)-3-(2-hydroxy-ethyl)-6-trifluoromethyl-1H-quinolin-2-one

4-(5-chloro-2-methoxyphenyl)-3-(2-hydroxyethyl)-6-(trifluoromethyl)-2(1H)-quinolinone

(2-amino-5-trifluoromethyl-phenyl)-(5-chloro-2-methoxy-phenyl)-methanone

Downstream raw materials:

3-[2-(tert-butyl-diphenyl-silanyloxy)-ethyl]-4-(5-chloro-2-hydroxy-phenyl)-6-trifluoromethyl-1H-quinolin-2-one

3-(2-(tert-butyldiphenylsilyloxy)ethyl)-4-(5-chloro-2-(2-methylallyloxy)phenyl)-1-methyl-6-(trifluoromethyl)quinolin-2(1H)-one

4-(3-allyl-5-chloro-2-hydroxyphenyl)-3-(2-(tert-butyldiphenylsilyloxy)ethyl)-1-methyl-6-(trifluoromethyl)quinolin-2(1H)-one

3-(2-(tert-butyldiphenylsilyloxy)ethyl)-4-(5-chloro-2-hydroxy-3-(2-methylallyl)phenyl)-1-methyl-6-(trifluoromethyl)quinolin-2(1H)-one