374067-80-8

Basic information

• Product Name: 4-[(4,6-Dihydroxy-2-pyrimidinyl)amino]benzonitrile
• Synonyms: 4-[(4,6-Dihydroxy-2-pyrimidinyl)amino]benzonitrile;4-((4,6-dihydroxypyrimidin-2-yl)amino)benzonitrile;4-[(1,4-Dihydro-6-hydroxy-4-oxo-2-pyrimidinyl)amino]benzonitrile;4-[(4-hydroxy-6-oxo-1H-pyriMidin-2-yl)aMino]benzonitrile;4-(4,6-dihydro×ypyriMidin-2-ylaMino)benzonitrile;4-((4-Hydroxy-6-oxo-1,6-dihydropyriMidin-2-yl)aMino)benzonitrile;4-((6-hydroxy-4-oxo-1,4-dihydropyrimidin-2-yl)amino)benzonitrile;4-[(1,6-dihydro-4-hydroxy-6-oxo-2-pyrimidinyl)amino]benzonitrile
• CAS NO: 374067-80-8
• Molecular Formula: C₁₁H₈N₄O₂
• Molecular Weight: 228.20682
• Product Categories: Amines;Aroamtics;Heterocycles;Intermediates & Fine Chemicals;Pharmaceuticals;Intermediate of Etravirine
• Mol File: 374067-80-8.mol
• Article Data: 5

Chemical Properties

• Appearance: /
• Density: 1.44
• Vapor Pressure: 0-0Pa at 20-25℃
• Refractive Index: 1.696
• Storage Temp.: 2-8°C
• Solubility: DMSO (Slightly), Methanol (Slightly)
• CAS DataBase Reference: 4-[(4,6-Dihydroxy-2-pyrimidinyl)amino]benzonitrile(CAS DataBase Reference)
• NIST Chemistry Reference: 4-[(4,6-Dihydroxy-2-pyrimidinyl)amino]benzonitrile(374067-80-8)
• EPA Substance Registry System: 4-[(4,6-Dihydroxy-2-pyrimidinyl)amino]benzonitrile(374067-80-8)

Safety Data

• Hazardous Substances Data: 374067-80-8(Hazardous Substances Data)

Usage

Uses

Intermediate in the preparation of HIV replication inhibitors

InChI:InChI=1/C11H8N4O2/c12-6-7-1-3-8(4-2-7)13-11-14-9(16)5-10(17)15-11/h1-5H,(H3,13,14,15,16,17)

Upstream product

• 873-74-5 4-Aminobenzonitrile 
• 5637-42-3 1-(4-cyanophenyl)guanidine 
• 105-53-3 diethyl malonate 
• 373690-68-7 4-cyanophenyl guanidine hydrochloride 

Downstream Products

• 1070377-34-2 4-[[6-chloro-2-[(4-cyanophenyl)amino]-4-pyrimidinyl]oxy]-3,5-dimethyl-benzonitrile 
• 1398507-09-9 4-((4-amino-5-bromo-6-chloropyrimidin-2-yl)amino)benzonitrile 
• 269055-15-4 etravirine 
• 269055-76-7 4-[[5-bromo-4-(4-cyano-2,6-dimethylphenoxy)-6-chloro-2-pyrimidinyl]amino]-benzonitrile 
• 269055-75-6 4-[[(5-bromo-4,6-dichloro)-2-pyrimidinyl]amino]benzonitrile 
• 329187-59-9 4-(4,6-dichloropyrimidine-2-yl-amino)benzonitrile 
• 1207204-97-4 C₁₃H₆F₆N₄O₆S₂ 

Relevant articles and documents

Process for the Synthesis of Etravirine and Its Intermediates

The invention discloses the synthesis of Etravirine via intermediate 4-((4-amino-5-bromo-6-chloropyrimidin-2-yl) amino)benzonitrile and process for the preparation of Etravirine of the formula-I.

A PROCESS FOR ETRA VIRINE INTERMEDIATE AND POLYMORPHS OF ETRAVIRINE

4-[[6-chloro-2-[(4-cyanophenyl)amino]-4-pyrimidinyl]oxy]-3,5-dimethyl- benzonitrile is a key intermediate for the preparation of etravirine. The present invention provides a process for preparation of 4-[[6-chloro-2-[(4-cyanophenyl)amino]-4- pyrimidinyl]oxy]-3,5-dimethylbenzonitrile. The present invention also provides a novel process for the preparation of etravirine crystalline form I. The present invention further provides novel crystalline forms of etravirine, processes for their preparation and pharmaceutical compositions comprising them.

Evolution of anti-HIV drug candidates. Part 3: Diarylpyrimidine (DAPY) analogues

The synthesis and anti-HIV-1 activity of a series of diarylpyrimidines (DAPYs) are described. Several members of this novel class of non-nucleoside reverse transcriptase inhibitors (NNRTIs) are extremely potent against both wild-type and a panel of clinically significant single- and double-mutant strains of HIV-1.