N-{5-[(4-{[5-Chloro-4-fluoro-2-(2-hydroxy-2-propanyl)phenyl]amino}-2-pyrimidinyl)amino]-2-[(3S)-3-(dimethylamino)-1-pyrrolidinyl]-4-methoxyphenyl}acrylamide | CAS No. 2370013-49-1

N-{5-[(4-{[5-Chloro-4-fluoro-2-(2-hydroxy-2-propanyl)phenyl]amino}-2-pyrimidinyl)amino]-2-[(3S)-3-(dimethylamino)-1-pyrrolidinyl]-4-methoxyphenyl}acrylamide

Basic Information

CAS Number

2370013-49-1

Molecular Formula

C29H35ClFN7O3

Molecular Weight

584.1 g/mol

AD

Basic Physical Properties

CN(C)[C@@H]1CN(CC1)C1C=C(OC)C(=CC=1NC(=O)C=C)NC1N=C(C=CN=1)NC1C=C(Cl)C(F)=CC=1C(C)(C)O

InChI

InChI=1S/C29H35ClFN7O3/c1-7-27(39)34-22-14-23(25(41-6)15-24(22)38-11-9-17(16-38)37(4)5)35-28-32-10-8-26(36-28)33-21-13-19(30)20(31)12-18(21)29(2,3)40/h7-8,10,12-15,17,40H,1,9,11,16H2,2-6H3,(H,34,39)(H2,32,33,35,36)/t17-/m0/s1

InChIKey

BTMKEDDEMKKSEF-KRWDZBQOSA-N

LogP

5.257100000000005

Topological Polar Surface Area

114.88000000000001 Ų

Hydrogen Bond Donor/Acceptor

4 / 10

Complexity

885

Synonyms & References

English

  • 2-Propenamide, N-[5-[[4-[[5-chloro-4-fluoro-2-(1-hydroxy-1-methylethyl)phenyl]amino]-2-pyrimidinyl]amino]-2-[(3S)-3-(dimethylamino)-1-pyrrolidinyl]-4-methoxyphenyl]-
  • (S)-Sunvozertinib

FAQ

What are the physical and chemical properties of N-{5-[(4-{[5-Chloro-4-fluoro-2-(2-hydroxy-2-propanyl)phenyl]amino}-2-pyrimidinyl)amino]-2-[(3S)-3-(dimethylamino)-1-pyrrolidinyl]-4-methoxyphenyl}acrylamide (CAS: 2370013-49-1)?

This compound is a crystalline solid with a molecular weight of approximately 660.5 g/mol. It has low water solubility and moderate solubility in organic solvents like DMSO. The compound is reactive, particularly towards nucleophiles and reducing agents, and may undergo hydrolysis under basic conditions. It is stable under normal storage conditions but requires protection from moisture and light.

How is N-{5-[(4-{[5-Chloro-4-fluoro-2-(2-hydroxy-2-propanyl)phenyl]amino}-2-pyrimidinyl)amino]-2-[(3S)-3-(dimethylamino)-1-pyrrolidinyl]-4-methoxyphenyl}acrylamide (CAS: 2370013-49-1) typically synthesized?

This compound is synthesized via a multistep process involving the coupling of an amino pyrimidine derivative with a pyrrolidine-containing methoxyphenyl acrylamide. The synthesis typically requires mild to moderate conditions, with the use of catalysts such as EDC and HOBt, and provides good to excellent yields. The process involves protecting groups and careful control of reaction conditions to ensure high selectivity and purity.

What industries use N-{5-[(4-{[5-Chloro-4-fluoro-2-(2-hydroxy-2-propanyl)phenyl]amino}-2-pyrimidinyl)amino]-2-[(3S)-3-(dimethylamino)-1-pyrrolidinyl]-4-methoxyphenyl}acrylamide (CAS: 2370013-49-1)?

This compound is primarily used in the pharmaceutical industry for the development of novel drugs. It may also find applications in the polymer industry for specific functional materials, in sensor technology for detection of specific analytes, and in semiconductor manufacturing for certain process chemicals. Its unique chemical properties make it versatile for a range of advanced applications.

What precautions should be taken when handling N-{5-[(4-{[5-Chloro-4-fluoro-2-(2-hydroxy-2-propanyl)phenyl]amino}-2-pyrimidinyl)amino]-2-[(3S)-3-(dimethylamino)-1-pyrrolidinyl]-4-methoxyphenyl}acrylamide (CAS: 2370013-49-1)?

Proper PPE (Personal Protective Equipment) should be worn, including gloves, goggles, and a lab coat, when handling this compound. Work should be conducted in a well-ventilated fume hood. The compound should be stored in a cool, dry place away from moisture and light. In case of a spill, immediately use appropriate spill cleanup materials and follow the manufacturer's guidelines for disposal. Always refer to the Safety Data Sheet (SDS) for detailed handling and emergency procedures.

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