raltegravir

Base Information

• Chemical Name: raltegravir
• CAS No.: 1193687-87-4
• Molecular Formula: C₂₀H₂₂N₆O₅
• Molecular Weight: 426.432
• Hs Code.: 2934990002
• Mol file: 1193687-87-4.mol

Synonyms:

Chemical Property of raltegravir

Chemical Property:

Purity/Quality:

99.90% ^*data from raw suppliers

4-DefluoroRaltegravir ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Uses: 4-Defluoro Raltegravir is an impurity of Raltegravir (R100300) which is a potent human immunodeficiency virus (HIV) integrase inhibitor.

Technology Process of raltegravir

There total 4 articles about raltegravir 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:

5-methyl-1,3,4-oxadiazole-2-carboxylic acid chloride (889131-28-6) + 2-(2-aminopropan-2-yl)-N-benzyl-1,6-dihydro-5-hydroxy-1-methyl-6-oxopyrimidine-4-carboxamide (1403457-41-9) → raltegravir (1193687-87-4)

Guidance literature:

With 4-methyl-morpholine; In tetrahydrofuran; acetonitrile; at 0 - 5 ℃; for 1h;

DOI:10.1021/op300077m

Reference yield:

C24H26N4O5 (1391918-11-8) → raltegravir (1193687-87-4)

Guidance literature:

Multi-step reaction with 2 steps

1: 10% Pd/C; methanesulfonic acid; hydrogen / methanol / 50 - 55 °C / 1500.15 Torr / Autoclave

2: 4-methyl-morpholine / acetonitrile; tetrahydrofuran / 1 h / 0 - 5 °C

With 4-methyl-morpholine; methanesulfonic acid; 10% Pd/C; hydrogen; In tetrahydrofuran; methanol; acetonitrile;

DOI:10.1021/op300077m

Reference yield:

benzylamine (100-46-9) → raltegravir (1193687-87-4)

Guidance literature:

Multi-step reaction with 3 steps

1: methanol / 60 - 65 °C

2: 10% Pd/C; methanesulfonic acid; hydrogen / methanol / 50 - 55 °C / 1500.15 Torr / Autoclave

3: 4-methyl-morpholine / acetonitrile; tetrahydrofuran / 1 h / 0 - 5 °C

With 4-methyl-morpholine; methanesulfonic acid; 10% Pd/C; hydrogen; In tetrahydrofuran; methanol; acetonitrile;

DOI:10.1021/op300077m

upstream raw materials:

2-(1-benzyloxycarbonylamino-1-methyl-ethyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydro-pyrimidine-4-carboxylic acid methyl ester

5-methyl-1,3,4-oxadiazole-2-carboxylic acid chloride

2-(2-aminopropan-2-yl)-N-benzyl-1,6-dihydro-5-hydroxy-1-methyl-6-oxopyrimidine-4-carboxamide

C₂₄H₂₆N₄O₅

Refernces