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CAS 1453315-78-0

:

5-Thia-2-azaspiro[3.4]octane-2-carboxylic acid, 7-hydroxy-, 1,1-dimethylethyl ester, 5,5-dioxide

Description:
5-Thia-2-azaspiro[3.4]octane-2-carboxylic acid, 7-hydroxy-, 1,1-dimethylethyl ester, 5,5-dioxide, identified by CAS number 1453315-78-0, is a chemical compound characterized by its unique spirocyclic structure, which incorporates both sulfur and nitrogen atoms. This compound features a carboxylic acid functional group, which is esterified with a tert-butyl group, enhancing its lipophilicity and potentially influencing its biological activity. The presence of a hydroxyl group contributes to its polarity and may play a role in hydrogen bonding interactions. The 5,5-dioxide moiety indicates the presence of sulfone functionalities, which can affect the compound's reactivity and stability. Overall, this compound's structural features suggest potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to its complex architecture and functional groups that may interact with biological targets. However, specific properties such as solubility, melting point, and biological activity would require empirical data for comprehensive characterization.
Formula:C11H19NO5S
InChI:InChI=1S/C11H19NO5S/c1-10(2,3)17-9(14)12-6-11(7-12)4-8(13)5-18(11,15)16/h8,13H,4-7H2,1-3H3
InChI key:InChIKey=ZKCKSGZYCIBCKJ-UHFFFAOYSA-N
SMILES:O=S1(=O)C2(CN(C(OC(C)(C)C)=O)C2)CC(O)C1
Synonyms:
  • 5-Thia-2-azaspiro[3.4]octane-2-carboxylic acid, 7-hydroxy-, 1,1-dimethylethyl ester, 5,5-dioxide
  • 2-Boc-7-hydroxy-5-thia-2-azaspiro[3.4]octane 5,5-Dioxide
  • 7-Hydroxy-5-thia-2-azaspiro[3.4]octane-2-carboxylic acid-5,5-dioxide 1,1-dimethylethyl ester
  • octane-
  • tert-butyl 7-hydroxy-5,5-dioxo-5$l^{6}-thia-2-azaspiro[3.4]octane-2-carboxylate
  • Tert-Butyl 7-Hydroxy-5-Thia-2-Azaspiro[3.4]Octane-2-Carboxylate 5,5-Dioxide(WX101710)
  • 5-
  • thia-
  • carboxylic acid-5,5-dioxide 1,1-dimethylethyl ester
  • Hydroxy-
  • See more synonyms
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