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CAS 1228552-62-2

:

1,1-Dimethylethyl (2S)-2-(5-iodo-1H-imidazol-2-yl)-1-pyrrolidinecarboxylate

Description:
1,1-Dimethylethyl (2S)-2-(5-iodo-1H-imidazol-2-yl)-1-pyrrolidinecarboxylate, identified by its CAS number 1228552-62-2, is a chemical compound characterized by its complex structure, which includes a pyrrolidine ring and an imidazole moiety. The presence of the 5-iodo substituent on the imidazole ring suggests potential reactivity and biological activity, as halogenated compounds often exhibit unique pharmacological properties. The dimethyl group attached to the carbon chain contributes to steric hindrance, which can influence the compound's interaction with biological targets. This compound may be of interest in medicinal chemistry, particularly in the development of pharmaceuticals, due to its potential to act as a ligand or inhibitor in various biochemical pathways. Its stereochemistry, indicated by the (2S) configuration, is crucial for determining its biological activity and interaction with enzymes or receptors. Overall, this compound exemplifies the intricate relationship between molecular structure and biological function, making it a subject of interest for further research and application in drug development.
Formula:C12H18IN3O2
InChI:InChI=1S/C12H18IN3O2/c1-12(2,3)18-11(17)16-6-4-5-8(16)10-14-7-9(13)15-10/h7-8H,4-6H2,1-3H3,(H,14,15)/t8-/m0/s1
InChI key:InChIKey=NSXDWECYTNLRMJ-QMMMGPOBSA-N
SMILES:C(OC(C)(C)C)(=O)N1[C@@H](CCC1)C=2NC(I)=CN2
Synonyms:
  • 1-Pyrrolidinecarboxylic acid, 2-(5-iodo-1H-imidazol-2-yl)-, 1,1-dimethylethyl ester, (2S)-
  • (S)-tert-Butyl 2-(5-iodo-1H-imidazol-2-yl)pyrrolidine-1-carboxylate
  • 1,1-Dimethylethyl (2S)-2-(5-iodo-1H-imidazol-2-yl)-1-pyrrolidinecarboxylate
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