LY-2795050

Base Information

• Chemical Name: LY-2795050
• CAS No.: 1346133-08-1
• Molecular Formula: C₂₃H₂₂ClN₃O₂
• Molecular Weight: 407.9
• Mol file: 1346133-08-1.mol

Synonyms:3-chloro-4-[4-[ [ (2S)-2-(3-pyridyl)pyrrolidin-1-yl]methyl]phenoxy]benzamide

Chemical Property of LY-2795050

Chemical Property:

• Boiling Point: 532.4±50.0 °C(Predicted)
• PKA: 15.57±0.50(Predicted)
• Density: 1.287±0.06 g/cm3(Predicted)

Purity/Quality:

97% ^*data from raw suppliers

LY2795050 >98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of LY-2795050

There total 10 articles about LY-2795050 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: 68.0%

3-chloro-4-(4-formylphenoxy)benzamide (676494-59-0) + nornicotine (494-97-3,13450-58-3) → 3-chloro-4-[4-[ [ (2S)-2-(3-pyridyl)pyrrolidin-1-yl]methyl]phenoxy]benzamide (1346133-08-1)

Guidance literature:

With sodium tris(acetoxy)borohydride; acetic acid; In 1,2-dichloro-ethane; at 20 ℃;

DOI:10.1021/jm200789r

Reference yield:

C23H21ClN3O2(1+) → 3-chloro-4-[4-[ [ (2S)-2-(3-pyridyl)pyrrolidin-1-yl]methyl]phenoxy]benzamide (1346133-08-1)

Guidance literature:

With sodium tris(acetoxy)borohydride; acetic acid; In 1,2-dichloro-ethane; at 20 ℃; for 4h;

DOI:10.1021/acsmedchemlett.8b00460

Reference yield:

4-hydroxy-benzaldehyde (123-08-0,65581-83-1) → 3-chloro-4-[4-[ [ (2S)-2-(3-pyridyl)pyrrolidin-1-yl]methyl]phenoxy]benzamide (1346133-08-1)

Guidance literature:

Multi-step reaction with 3 steps

1: potassium carbonate / N,N-dimethyl-formamide / 2 h / Heating

2: dihydrogen peroxide / water; dimethyl sulfoxide / 2 h / 10 - 20 °C / Alkaline conditions

3: sodium tris(acetoxy)borohydride; acetic acid / 1,2-dichloro-ethane / 20 °C

With dihydrogen peroxide; sodium tris(acetoxy)borohydride; potassium carbonate; acetic acid; In water; dimethyl sulfoxide; 1,2-dichloro-ethane; N,N-dimethyl-formamide;

DOI:10.1021/jm200789r

upstream raw materials:

3-chloro-4-(4-formylphenoxy)benzonitrile

3-chloro-4-(4-formylphenoxy)benzamide

nornicotine

4-hydroxy-benzaldehyde