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CAS 1420478-89-2

:

Phenylmethyl (2S)-2-[8-amino-1-[4-[(2-pyridinylamino)carbonyl]phenyl]imidazo[1,5-a]pyrazin-3-yl]-1-pyrrolidinecarboxylate

Description:
Phenylmethyl (2S)-2-[8-amino-1-[4-[(2-pyridinylamino)carbonyl]phenyl]imidazo[1,5-a]pyrazin-3-yl]-1-pyrrolidinecarboxylate, identified by its CAS number 1420478-89-2, is a complex organic compound characterized by its multi-ring structure and various functional groups. This substance features an imidazo[1,5-a]pyrazine core, which is known for its biological activity, particularly in medicinal chemistry. The presence of amino and carbonyl groups suggests potential interactions with biological targets, making it a candidate for pharmaceutical applications. The pyrrolidinecarboxylate moiety indicates that it may exhibit specific stereochemistry, which can influence its biological activity and binding affinity. Additionally, the compound's structure includes aromatic rings, contributing to its stability and potential for π-π stacking interactions. Overall, this compound's intricate structure and functional groups suggest it may possess significant pharmacological properties, warranting further investigation in drug development and therapeutic applications.
Formula:C30H27N7O3
InChI:InChI=1S/C30H27N7O3/c31-27-26-25(21-11-13-22(14-12-21)29(38)34-24-10-4-5-15-32-24)35-28(37(26)18-16-33-27)23-9-6-17-36(23)30(39)40-19-20-7-2-1-3-8-20/h1-5,7-8,10-16,18,23H,6,9,17,19H2,(H2,31,33)(H,32,34,38)/t23-/m0/s1
InChI key:InChIKey=PBYIGYPMLIQOEW-QHCPKHFHSA-N
SMILES:C(OCC1=CC=CC=C1)(=O)N2[C@H](C=3N4C(=C(N3)C5=CC=C(C(NC6=CC=CC=N6)=O)C=C5)C(N)=NC=C4)CCC2
Synonyms:
  • 1-Pyrrolidinecarboxylic acid, 2-[8-amino-1-[4-[(2-pyridinylamino)carbonyl]phenyl]imidazo[1,5-a]pyrazin-3-yl]-, phenylmethyl ester, (2S)-
  • ACALABRUTINIB N-2
  • pyrazin-3-yl}-pyrrolidine-1-carboxylic acid benzyl ester
  • benzyl (S)-2-(8-amino-1-(4-(pyridin-2-ylcarbamoyl)phenyl)imidazo[1,5-a]pyrazin-3-yl)pyrrolidine-1-carboxylate
  • BENZYL (S)-2-(8-AMINO-1-(4-(PYRIDIN-2-YLCARBAMOYL)PHENYL)IMIDAZO[1,5-A]PYRAZIN-3-YL)PYRROLIDINE-1-CA
  • (S)-Benzyl 2-(8-amino-1-(4-(pyridin-2-ylcarbamoyl)phenyl)imidazo[1,5-a]pyrazin-3-yl)pyrrolidine-1-carboxylate
  • Phenylmethyl (2S)-2-[8-amino-1-[4-[(2-pyridinylamino)carbonyl]phenyl]imidazo[1,5-a]pyrazin-3-yl]-1-pyrrolidinecarboxylate
  • (S)-benzyl 2-(8-amino-1-(4-(pyridin-2-ylcarbamoyl)phenyl)imidazo[1,5-a]pyrazin-3-yl)pyrrolidine-1-carboxylate
  • (S)-2-{8-Amino-1-[4-(pyridin-2-ylcarbamoyl)-phenyl]-imidazo[1,5-a]
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