PQR530

Base Information

• Chemical Name: PQR530
• CAS No.: 1927857-61-1
• Molecular Formula: C₁₈H₂₃F₂N₇O₂
• Molecular Weight: 407.423
• Mol file: 1927857-61-1.mol

Synonyms:

Chemical Property of PQR530

Chemical Property:

• Boiling Point: 660.7±65.0 °C(Predicted)
• PKA: 5.05±0.10(Predicted)
• Density: 1.338±0.06 g/cm3(Predicted)

Purity/Quality:

97% ^*data from raw suppliers

PQR530 >98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of PQR530

There total 11 articles about PQR530 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: 74.0%

→ (S)-4-(difluoromethyl)-5-(4-(3-methylmorpholino)-6-morpholino-1,3,5-triazin-2-yl)pyridin-2-amine (1927857-61-1)

Guidance literature:

With potassium phosphate; (chloro(2-dicyclohexylphosphino-2′,4′,6′-triisopropyl-1,1′-biphenyl)[2-(2′-amino-1,1′-biphenyl)]palladium(II)); In 1,4-dioxane; water; at 95 ℃; for 2h; Inert atmosphere;

With hydrogenchloride; In water; at 60 ℃;

Reference yield: 73.0%

2-chloro-4-[(3R)-3-methylmorpholin-4-yl]-6-(morpholin-4-yl)-1,3,5-triazine + N′-[4-(difluoromethyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]-N,N-dimethylmethanimidamide → 4-(difluoromethyl)-5-{4-[(3R)-3-methylmorpholin-4-yl]-6-(morpholin-4-yl)-1,3,5-triazin-2-yl}pyridin-2-amine (1927857-61-1)

Guidance literature:

With potassium phosphate; chloro(2-dicyclohexylphosphino-2’,4’,6’-triisopropyl-1,1‘-biphenyl)[2-(2’-amino-1,1‘-biphenyl’)]palladium(II); In 1,4-dioxane; water; at 95 ℃; Inert atmosphere;

DOI:10.1021/acs.jmedchem.8b01262

Reference yield: 73.0%

N′-[4-(difluoromethyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]-N,N-dimethylmethanimidamide + 2-chloro-4-[(3R)-3-methylmorpholin-4-yl]-6-(morpholin-4-yl)-1,3,5-triazine → 4-(difluoromethyl)-5-{4-[(3R)-3-methylmorpholin-4-yl]-6-(morpholin-4-yl)-1,3,5-triazin-2-yl}pyridin-2-amine (1927857-61-1)

Guidance literature:

N′-[4-(difluoromethyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]-N,N-dimethylmethanimidamide; 2-chloro-4-[(3R)-3-methylmorpholin-4-yl]-6-(morpholin-4-yl)-1,3,5-triazine; With potassium phosphate; chloro(2-dicyclohexylphosphino-2’,4’,6’-triisopropyl-1,1‘-biphenyl)[2-(2’-amino-1,1‘-biphenyl’)]palladium(II); In 1,4-dioxane; water; at 95 ℃; Inert atmosphere;

With hydrogenchloride; In 1,4-dioxane; water; at 60 ℃; Inert atmosphere;

DOI:10.1021/acs.jmedchem.0c00620

upstream raw materials:

2,6-Dichloro-4-morpholino-1,3,5-triazine

2-chloro-4-[(3S)-3-methylmorpholin-4-yl]-6-(morpholin-4-yl)-1,3,5-triazine

(S)-3-methylmorpholine

2-chloro-4-(difluoromethyl)pyridine