Panobinostat Carboxylic Acid Methyl Ester Hydrochloride

Base Information

• Chemical Name: Panobinostat Carboxylic Acid Methyl Ester Hydrochloride
• CAS No.: 441741-66-8
• Molecular Formula: C22H24ClN2O2
• Molecular Weight: 384.906
• Mol file: 441741-66-8.mol

Synonyms:Panobinostat Carboxylic Acid Methyl Ester Hydrochloride;(2E)-3-[4-[[[2-(2-Methyl-1H-indol-3-yl)ethyl]aMino]Methyl]phenyl]-2-propenoic Acid Methyl Ester, Hydrochloride

Chemical Property of Panobinostat Carboxylic Acid Methyl Ester Hydrochloride

Chemical Property:

• PSA: 54.12000
• LogP: 5.18770
• Solubility.: Chloroform, Dichloromethane,

Purity/Quality:

99% ^*data from raw suppliers

PanobinostatCarboxylicAcidMethylEsterHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Uses: Intermediate in the preparation of Panobinostat

Technology Process of Panobinostat Carboxylic Acid Methyl Ester Hydrochloride

There total 4 articles about Panobinostat Carboxylic Acid Methyl Ester Hydrochloride 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: 90.4%

2-methyltryptamine (2731-06-8) + methyl (2E)-3-(4-formylphenyl)acrylate (7560-50-1,71093-79-3,58045-41-3) → (E)-3-[4-[[2-(2-methyl-1H-indol-3-yl)ethylamino]methyl]phenyl]acrylic acid methyl ester hydrochloride (441741-66-8)

Guidance literature:

2-methyltryptamine; methyl (2E)-3-(4-formylphenyl)acrylate; In methanol; at 25 - 35 ℃; for 1h;

With hydrogenchloride; In ethanol; water; at 0 - 5 ℃; for 1h; pH=3 - 4; Solvent; Temperature;

Reference yield: 55.0%

2-methyltryptamine (2731-06-8) + Methyl diethylphosphonoacetate (1067-74-9) + 4-chloromethylbenzaldehyde (73291-09-5) → (E)-3-[4-[[2-(2-methyl-1H-indol-3-yl)ethylamino]methyl]phenyl]acrylic acid methyl ester hydrochloride (441741-66-8)

Guidance literature:

With 1,8-diazabicyclo[5.4.0]undec-7-ene; lithium chloride; In N,N-dimethyl-formamide; at 0 - 25 ℃; for 6h; Reagent/catalyst; Solvent; Temperature; Inert atmosphere;

DOI:10.3184/174751918X15357309308931

Reference yield:

(E)-3-[4-[[[2-(2-methyl-1H-indol-3-yl)ethyl]amino]methyl]phenyl]acrylic acid methyl ester (441741-65-7) → (E)-3-[4-[[2-(2-methyl-1H-indol-3-yl)ethylamino]methyl]phenyl]acrylic acid methyl ester hydrochloride (441741-66-8)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; methanol;

upstream raw materials:

(E)-3-[4-[[[2-(2-methyl-1H-indol-3-yl)ethyl]amino]methyl]phenyl]acrylic acid methyl ester

2-methyltryptamine

methyl (2E)-3-(4-formylphenyl)acrylate

Methyl diethylphosphonoacetate

Downstream raw materials:

panobinostat

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