5-[(7-benzyloxyquinazolin-4-yl)amino]-4-fluoro-2-methyl-phenol;hydrochloride | CAS No. 324077-30-7

5-[(7-benzyloxyquinazolin-4-yl)amino]-4-fluoro-2-methyl-phenol;hydrochloride

Basic Information

CAS Number

324077-30-7

Molecular Formula

C22H19ClFN3O2

Molecular Weight

411.86 g/mol

AD

Basic Physical Properties

Cc1cc(c(cc1O)Nc2c3ccc(cc3ncn2)OCc4ccccc4)F.Cl

InChI

InChI=1S/C22H18FN3O2.ClH/c1-14-9-18(23)20(11-21(14)27)26-22-17-8-7-16(10-19(17)24-13-25-22)28-12-15-5-3-2-4-6-15;/h2-11,13,27H,12H2,1H3,(H,24,25,26);1H

InChIKey

AVRHWGLIYGJSOD-UHFFFAOYSA-N

LogP

5.527320000000004

Topological Polar Surface Area

67.27 Ų

Hydrogen Bond Donor/Acceptor

2 / 5

Synonyms & References

English

  • 5-((7-BENZYLOXYQUINAZOLIN-4-YL)AMINO)-4-FLUORO-2-METHYLPHENOL HYDROCHLORIDE
  • ZM 323881 HCL
  • ZM 323881 HYDROCHLORIDE
  • ZM323881
  • ZM-323881

MDL Number

MFCD05222988

FAQ

What are the physical and chemical properties of 5-[(7-benzyloxyquinazolin-4-yl)amino]-4-fluoro-2-methyl-phenol hydrochloride (CAS: 324077-30-7)?

5-[(7-benzyloxyquinazolin-4-yl)amino]-4-fluoro-2-methyl-phenol hydrochloride is a crystalline compound with a molecular weight of approximately 529.8 g/mol. It is poorly soluble in water but soluble in organic solvents like methanol and ethanol. This compound exhibits low reactivity under normal conditions but can undergo substitution reactions in the presence of appropriate reagents. Its hydrochloride salt form is commonly used in pharmaceutical applications due to its stability and solubility properties.

How is 5-[(7-benzyloxyquinazolin-4-yl)amino]-4-fluoro-2-methyl-phenol hydrochloride (CAS: 324077-30-7) typically synthesized?

5-[(7-benzyloxyquinazolin-4-yl)amino]-4-fluoro-2-methyl-phenol hydrochloride is typically synthesized through a multistep process involving the condensation of a suitable aminoquinazoline derivative with 4-fluoro-2-methylphenol. The reaction is catalyzed by a Lewis acid and proceeds with good selectivity and yield. The final product is obtained as its hydrochloride salt, which is then purified by recrystallization.

What industries use 5-[(7-benzyloxyquinazolin-4-yl)amino]-4-fluoro-2-methyl-phenol hydrochloride (CAS: 324077-30-7)?

5-[(7-benzyloxyquinazolin-4-yl)amino]-4-fluoro-2-methyl-phenol hydrochloride is primarily used in the pharmaceutical industry for the development of new drugs. It is also relevant in the chemical industry for its potential applications in sensors, semiconductors, and as a precursor in polymer synthesis. Its unique chemical structure makes it suitable for various research and development purposes.

What precautions should be taken when handling 5-[(7-benzyloxyquinazolin-4-yl)amino]-4-fluoro-2-methyl-phenol hydrochloride (CAS: 324077-30-7)?

When handling 5-[(7-benzyloxyquinazolin-4-yl)amino]-4-fluoro-2-methyl-phenol hydrochloride, it is essential to wear appropriate personal protective equipment (PPE), including gloves and safety goggles. The compound should be used in a well-ventilated area or a fume hood to minimize inhalation risks. In case of spills, immediately clean up using appropriate absorbent materials and ensure proper disposal of waste. Always refer to the Safety Data Sheet (SDS) for detailed instructions on handling and storage.

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