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CAS 89398-05-0

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3-Thia-7-azabicyclo[3.3.1]nonan-9-one, 7-(phenylmethyl)-, perchlorate (1:1)

Description:
3-Thia-7-azabicyclo[3.3.1]nonan-9-one, 7-(phenylmethyl)-, perchlorate (1:1) is a chemical compound characterized by its bicyclic structure, which includes a sulfur atom (thia) and a nitrogen atom (azabicyclo) within its framework. The compound features a ketone functional group at the 9-position and a phenylmethyl substituent at the 7-position, contributing to its unique reactivity and potential biological activity. The perchlorate salt form indicates that it is paired with perchlorate ions, which can influence its solubility and stability in various solvents. This compound may exhibit interesting pharmacological properties due to its structural features, making it a subject of interest in medicinal chemistry. Its molecular interactions, including potential binding affinities and mechanisms of action, would be relevant for further exploration in drug development. As with many chemical substances, safety and handling precautions are essential, particularly due to the presence of perchlorate, which can pose environmental and health risks.
Formula:C14H17NOS·ClHO4
InChI:InChI=1S/C14H17NOS.ClHO4/c16-14-12-7-15(8-13(14)10-17-9-12)6-11-4-2-1-3-5-11;2-1(3,4)5/h1-5,12-13H,6-10H2;(H,2,3,4,5)
InChI key:InChIKey=PYYPJNLQRZBIBS-UHFFFAOYSA-N
SMILES:C(N1CC2C(=O)C(C1)CSC2)C3=CC=CC=C3.Cl(=O)(=O)(=O)O
Synonyms:
  • 3-Thia-7-azabicyclo[3.3.1]nonan-9-one, 7-(phenylmethyl)-, perchlorate
  • 3-Thia-7-azabicyclo[3.3.1]nonan-9-one, 7-(phenylmethyl)-, perchlorate (1:1)
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