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CAS 2230198-02-2

:

2-[[4-[6-[(4-Cyano-2-fluorophenyl)methoxy]-2-pyridinyl]-1-piperidinyl]methyl]-1-[(2S)-2-oxetanylmethyl]-1H-benzimidazole-6-carboxylic acid

Description:
The chemical substance known as 2-[[4-[6-[(4-Cyano-2-fluorophenyl)methoxy]-2-pyridinyl]-1-piperidinyl]methyl]-1-[(2S)-2-oxetanylmethyl]-1H-benzimidazole-6-carboxylic acid, with the CAS number 2230198-02-2, is a complex organic compound characterized by its multi-functional structure. It features a benzimidazole core, which is a bicyclic structure known for its biological activity, particularly in medicinal chemistry. The presence of a carboxylic acid group suggests potential for hydrogen bonding and solubility in polar solvents. Additionally, the compound contains a piperidine ring and a pyridine moiety, which may contribute to its pharmacological properties. The cyano and fluorine substituents enhance its electronic properties and may influence its reactivity and interaction with biological targets. Overall, this compound's intricate structure indicates potential applications in drug development, particularly in targeting specific biological pathways or receptors, although detailed studies would be necessary to elucidate its specific biological activity and therapeutic potential.
Formula:C31H30FN5O4
InChI:InChI=1S/C31H30FN5O4/c32-25-14-20(16-33)4-5-23(25)19-41-30-3-1-2-26(35-30)21-8-11-36(12-9-21)18-29-34-27-7-6-22(31(38)39)15-28(27)37(29)17-24-10-13-40-24/h1-7,14-15,21,24H,8-13,17-19H2,(H,38,39)/t24-/m0/s1
InChI key:InChIKey=HYBAKUMPISVZQP-DEOSSOPVSA-N
SMILES:C(N1C=2C(N=C1CN3CCC(CC3)C=4N=C(OCC5=C(F)C=C(C#N)C=C5)C=CC4)=CC=C(C(O)=O)C2)[C@@H]6CCO6
Synonyms:
  • 2-[[4-[6-[(4-Cyano-2-fluorophenyl)methoxy]-2-pyridinyl]-1-piperidinyl]methyl]-1-[(2S)-2-oxetanylmethyl]-1H-benzimidazole-6-carboxylic acid
  • 1H-Benzimidazole-6-carboxylic acid, 2-[[4-[6-[(4-cyano-2-fluorophenyl)methoxy]-2-pyridinyl]-1-piperidinyl]methyl]-1-[(2S)-2-oxetanylmethyl]-
  • PF 06882961
  • PF-06882961
  • Danuglipron
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