CAS 1691249-45-2: (7S)-4,5,6,7-Tetrahydro-7-[1-(1-oxo-2-propen-1-yl)-4-piperidinyl]-2-(4-phenoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

Description: The chemical substance known as (7S)-4,5,6,7-Tetrahydro-7-[1-(1-oxo-2-propen-1-yl)-4-piperidinyl]-2-(4-phenoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide, with the CAS number 1691249-45-2, is a complex organic compound characterized by its multi-cyclic structure and various functional groups. It features a pyrazolo[1,5-a]pyrimidine core, which is a bicyclic structure known for its biological activity. The presence of a tetrahydro moiety indicates saturation in part of the molecule, contributing to its three-dimensional conformation. The compound also contains a piperidine ring, which is often associated with pharmacological properties, and a phenoxyphenyl group that may enhance its lipophilicity and potential interactions with biological targets. The presence of a carboxamide functional group suggests potential for hydrogen bonding, which can influence solubility and reactivity. Overall, this compound may exhibit significant biological activity, making it of interest in medicinal chemistry and drug development, although specific biological properties would require further investigation.

Formula: C₂₇H₂₉N₅O₃

InChI: InChI=1S/C27H29N5O3/c1-2-23(33)31-16-13-18(14-17-31)22-12-15-29-27-24(26(28)34)25(30-32(22)27)19-8-10-21(11-9-19)35-20-6-4-3-5-7-20/h2-11,18,22,29H,1,12-17H2,(H2,28,34)/t22-/m0/s1

InChI key: InChIKey=RNOAOAWBMHREKO-QFIPXVFZSA-N

SMILES: O=C(N)C=1C(=NN2C1NCCC2C3CCN(C(=O)C=C)CC3)C=4C=CC(OC=5C=CC=CC5)=CC4

Synonyms:

• Pyrazolo[1,5-a]pyrimidine-3-carboxamide, 4,5,6,7-tetrahydro-7-[1-(1-oxo-2-propen-1-yl)-4-piperidinyl]-2-(4-phenoxyphenyl)-, (7S)-
• (S)-7-(1-Acryloylpiperidin-4-yl)-2-(4-phenoxyphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
• Zanubrutinib
• BGB-3111
• Pyrazolo[1,5-a]pyrimidine-3-carboxamide, 4,5,6,7-tetrahydro-7-[1-(1-oxo-2-propen-1-yl)-4-piperidinyl]-2-(4-phenoxyphenyl)-, (7S)-
• (7S)-4,5,6,7-Tetrahydro-7-[1-(1-oxo-2-propen-1-yl)-4-piperidinyl]-2-(4-phenoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
• Brukinsa
• BGB 3111

Zanubrutinib

CAS: 1691249-45-2

• Formula: C₂₇H₂₉N₅O₃
• Purity: 97%
• Color and Shape: Solid
• Molecular weight: 471.55085999999994

Zanubrutinib-d5

CAS: 1691249-45-2

• Formula: C₂₇H₂₄D₅N₅O₃
• Color and Shape: White To Off-White Solid
• Molecular weight: 476.59

zanubrutinib

CAS: 1691249-45-2

• Purity: ≥98%
• Molecular weight: 471.55g/mol

Zanubrutinib (BGB-3111)

CAS: 1691249-45-2

• Purity: 98%
• Molecular weight: 471.55g/mol

Zanubrutinib

CAS: 1691249-45-2

• Formula: C₂₇H₂₉N₅O₃
• Color and Shape: White To Off-White Solid
• Molecular weight: 471.56

zanubrutinib

CAS: 1691249-45-2

Zanubrutinib (BGB-3111) is an inhibitor of Bruton tyrosine kinase (BTK).

• Formula: C₂₇H₂₉N₅O₃
• Purity: 99.24% - 99.74%
• Color and Shape: Solid
• Molecular weight: 471.55

Zanubrutinib-13C3

CAS: 1691249-45-2

• Formula: C₃C₂₄H₂₉N₅O₃
• Color and Shape: Neat
• Molecular weight: 474.529

Zanubrutinib

CAS: 1691249-45-2

Inhibitor of Bruton's tyrosine kinase (BTK)

• Formula: C₂₇H₂₉N₅O₃
• Purity: Min. 95%
• Molecular weight: 471.55 g/mol