CAS 1225383-64-1: 4-[[2-Chloro-6-[(4-cyanophenyl)amino]-4-pyrimidinyl]oxy]-3,5-dimethylbenzonitrile

Description: 4-[[2-Chloro-6-[(4-cyanophenyl)amino]-4-pyrimidinyl]oxy]-3,5-dimethylbenzonitrile is a chemical compound characterized by its complex structure, which includes a pyrimidine ring, a chloro substituent, and a benzonitrile moiety. This compound features multiple functional groups, including an amino group and a nitrile group, contributing to its potential reactivity and biological activity. The presence of the chloro and cyano groups suggests that it may exhibit specific electronic properties, influencing its interactions in biological systems. The dimethyl groups on the benzene ring can affect the steric hindrance and solubility of the compound. Such characteristics make it of interest in medicinal chemistry, particularly in the development of pharmaceuticals targeting specific biological pathways. Its CAS number, 1225383-64-1, allows for precise identification and retrieval of information regarding its synthesis, properties, and applications in scientific literature. Overall, this compound exemplifies the complexity and diversity of organic molecules used in research and drug development.

Formula: C₂₀H₁₄ClN₅O

InChI: InChI=1S/C20H14ClN5O/c1-12-7-15(11-23)8-13(2)19(12)27-18-9-17(25-20(21)26-18)24-16-5-3-14(10-22)4-6-16/h3-9H,1-2H3,(H,24,25,26)

InChI key: InChIKey=CVCIISGTGYWJHF-UHFFFAOYSA-N

SMILES: N#CC1=CC=C(C=C1)NC=2N=C(Cl)N=C(OC=3C(=CC(C#N)=CC3C)C)C2

Synonyms:

• Benzonitrile, 4-[[2-chloro-6-[(4-cyanophenyl)amino]-4-pyrimidinyl]oxy]-3,5-dimethyl-
• 4-[[2-Chloro-6-[(4-cyanophenyl)amino]-4-pyrimidinyl]oxy]-3,5-dimethylbenzonitrile

Etravirine Impurity 2

CAS: 1225383-64-1

• Formula: C₂₀H₁₄ClN₅O
• Color and Shape: White To Off-White Solid
• Molecular weight: 375.82

Etravirine Impurity 8

CAS: 1225383-64-1

• Formula: C₂₀H₁₄ClN₅O
• Molecular weight: 375.8