Monohydroxy Netupitant

Base Information

• Chemical Name: Monohydroxy Netupitant
• CAS No.: 910808-12-7
• Molecular Formula: C₃₀H₃₂F₆N₄O₂
• Molecular Weight: 594.6
• Mol file: 910808-12-7.mol

Synonyms:Monohydroxy Netupitant;Netupitant metabolite Monohydroxy Netupitant

Chemical Property of Monohydroxy Netupitant

Chemical Property:

• Boiling Point: 651.5±55.0 °C(Predicted)
• PKA: 14.08±0.10(Predicted)
• PSA: 59.91000
• Density: 1.297±0.06 g/cm3(Predicted)
• LogP: 5.97380

Purity/Quality:

99%+, ^*data from raw suppliers

MonohydroxyNetupitant ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: Monohydroxy Netupitant is a derivative of Netupitant (N390950) which is a potent and selective neurokinin-1 receptor (NK1) receptor antagonist. Netupitant (N390950) is achiral and orally active.

Technology Process of Monohydroxy Netupitant

There total 1 articles about Monohydroxy Netupitant 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%

2-(3,5-bis-trifluoromethyl-phenyl)-N-[4-(2-formyl-phenyl)-6-(4-methyl-piperazin-1-yl)-pyridin-3-yl]-N-methyl-isobutyramide (910808-16-1) → 2-(3,5-bis-trifluoromethyl-phenyl)-N-[4-(2-hydroxymethyl-phenyl)-6-(4-methyl-piperazin-1-yl)-pyridin-3-yl]-N-methyl-isobutyramide (910808-12-7)

Guidance literature:

With sodium tetrahydroborate; In methanol; at 0 ℃; for 1h;

upstream raw materials:

2-(3,5-bis-trifluoromethyl-phenyl)-N-[4-(2-formyl-phenyl)-6-(4-methyl-piperazin-1-yl)-pyridin-3-yl]-N-methyl-isobutyramide

Refernces