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CAS 936563-97-2

:

1-[(3S)-3-[4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-1-piperidinyl]-2-propen-1-one

Description:
1-[(3S)-3-[4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-1-piperidinyl]-2-propen-1-one, with CAS number 936563-97-2, is a chemical compound characterized by its complex structure, which includes a piperidine ring, a pyrazolopyrimidine moiety, and a phenoxyphenyl group. This compound exhibits properties typical of small organic molecules, including potential biological activity due to its ability to interact with various biological targets. The presence of an amino group suggests it may participate in hydrogen bonding, enhancing its solubility and reactivity. Its propenone functional group indicates potential for electrophilic reactions, making it a candidate for further chemical modifications. The stereochemistry at the 3-position of the piperidine ring is significant, as it may influence the compound's pharmacological profile. Overall, this compound's unique structural features may contribute to its potential applications in medicinal chemistry, particularly in the development of therapeutic agents targeting specific pathways or diseases.
Formula:C25H24N6O2
InChI:InChI=1S/C25H24N6O2/c1-2-21(32)30-14-6-7-18(15-30)31-25-22(24(26)27-16-28-25)23(29-31)17-10-12-20(13-11-17)33-19-8-4-3-5-9-19/h2-5,8-13,16,18H,1,6-7,14-15H2,(H2,26,27,28)/t18-/m0/s1
InChI key:InChIKey=XYFPWWZEPKGCCK-SFHVURJKSA-N
SMILES:NC1=C2C(N(N=C2C3=CC=C(OC4=CC=CC=C4)C=C3)[C@@H]5CN(C(C=C)=O)CCC5)=NC=N1
Synonyms:
  • 2-Propen-1-one, 1-[(3S)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-1-piperidinyl]-
  • 1-[(3S)-3-[4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-1-piperidinyl]-2-propen-1-one
  • 1-[(3S)-3-[4-Amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one
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