3-[(1-cyano-4-hydroxy-7-(phenylsulfanyl)isoquinoline-3-carbonyl)amino]-2,2-dimethylpropionic acid methyl ester

Base Information

• Chemical Name: 3-[(1-cyano-4-hydroxy-7-(phenylsulfanyl)isoquinoline-3-carbonyl)amino]-2,2-dimethylpropionic acid methyl ester
• CAS No.: 1455093-84-1
• Molecular Formula: C₂₃H₂₁N₃O₄S
• Molecular Weight: 435.503
• Mol file: 1455093-84-1.mol

Synonyms:3-[(1-cyano-4-hydroxy-7-(phenylsulfanyl)isoquinoline-3-carbonyl)amino]-2,2-dimethylpropionic acid methyl ester

Chemical Property of 3-[(1-cyano-4-hydroxy-7-(phenylsulfanyl)isoquinoline-3-carbonyl)amino]-2,2-dimethylpropionic acid methyl ester

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 3-[(1-cyano-4-hydroxy-7-(phenylsulfanyl)isoquinoline-3-carbonyl)amino]-2,2-dimethylpropionic acid methyl ester

There total 3 articles about 3-[(1-cyano-4-hydroxy-7-(phenylsulfanyl)isoquinoline-3-carbonyl)amino]-2,2-dimethylpropionic acid methyl ester 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:

1-cyano-4-hydroxy-7-(phenylsulfanyl)isoquinoline-3-carboxylic acid butyl ester (945740-41-0) + methyl 3-amino-2,2-dimethylpropionate (25307-82-8) → 3-[(1-cyano-4-hydroxy-7-(phenylsulfanyl)isoquinoline-3-carbonyl)amino]-2,2-dimethylpropionic acid methyl ester (1455093-84-1)

Guidance literature:

In methanol; at 150 ℃; for 3h; Microwave irradiation;

Reference yield:

4-hydroxy-7-phenylsulfanylisoquinoline-3-carboxylic acid butyl ester (808115-46-0) → 3-[(1-cyano-4-hydroxy-7-(phenylsulfanyl)isoquinoline-3-carbonyl)amino]-2,2-dimethylpropionic acid methyl ester (1455093-84-1)

Guidance literature:

Multi-step reaction with 3 steps

1: bis(2,4,6-trimethylpyridine)iodine(I) hexafluorophosphate / dichloromethane / 16 h / 20 °C

2: N,N-dimethyl-formamide / 0.33 h / Reflux

3: methanol / 3 h / 150 °C / Microwave irradiation

With bis(2,4,6-trimethylpyridine)iodine(I) hexafluorophosphate; In methanol; dichloromethane; N,N-dimethyl-formamide;

Reference yield:

C20H18INO3S → 3-[(1-cyano-4-hydroxy-7-(phenylsulfanyl)isoquinoline-3-carbonyl)amino]-2,2-dimethylpropionic acid methyl ester (1455093-84-1)

Guidance literature:

Multi-step reaction with 2 steps

1: N,N-dimethyl-formamide / 0.33 h / Reflux

2: methanol / 3 h / 150 °C / Microwave irradiation

In methanol; N,N-dimethyl-formamide;

upstream raw materials:

4-hydroxy-7-phenylsulfanylisoquinoline-3-carboxylic acid butyl ester

1-cyano-4-hydroxy-7-(phenylsulfanyl)isoquinoline-3-carboxylic acid butyl ester

methyl 3-amino-2,2-dimethylpropionate

Downstream raw materials:

3-[(1-cyano-4-hydroxy-7-(phenylsulfanyl)isoquinoline-3-carbonyl)amino]-2,2-dimethylpropionic acid