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CAS 115887-91-7

:

1-Azetidinesulfonic acid, 2-methyl-4-oxo-3-[[(phenylmethoxy)carbonyl]amino]-, sodium salt (1:1), (2S,3S)-

Description:
1-Azetidinesulfonic acid, 2-methyl-4-oxo-3-[[(phenylmethoxy)carbonyl]amino]-, sodium salt (1:1), (2S,3S)- is a chemical compound characterized by its unique azetidine ring structure, which contributes to its biological activity. This compound features a sulfonic acid group, enhancing its solubility in water and making it a suitable candidate for various applications in pharmaceuticals and biochemistry. The presence of a phenylmethoxycarbonyl group indicates potential interactions with biological targets, while the 2-methyl and 4-oxo substituents may influence its reactivity and stability. As a sodium salt, it is likely to exhibit improved stability and solubility compared to its free acid form. The stereochemistry denoted by (2S,3S) suggests specific spatial arrangements of its atoms, which can be crucial for its biological function and interaction with enzymes or receptors. Overall, this compound's structural features suggest potential utility in medicinal chemistry, particularly in the development of therapeutic agents.
Formula:C12H14N2O6S·Na
InChI:InChI=1S/C12H14N2O6S.Na/c1-8-10(11(15)14(8)21(17,18)19)13-12(16)20-7-9-5-3-2-4-6-9;/h2-6,8,10H,7H2,1H3,(H,13,16)(H,17,18,19);/t8-,10-;/m0./s1
InChI key:InChIKey=KBEBCJMJULGVOR-GNAZCLTHSA-N
SMILES:S(=O)(=O)(O)N1[C@@H](C)[C@H](NC(OCC2=CC=CC=C2)=O)C1=O.[Na]
Synonyms:
  • 1-Azetidinesulfonic acid, 2-methyl-4-oxo-3-[[(phenylmethoxy)carbonyl]amino]-, monosodium salt, (2S-trans)-
  • 1-Azetidinesulfonic acid, 2-methyl-4-oxo-3-[[(phenylmethoxy)carbonyl]amino]-, sodium salt (1:1), (2S,3S)-
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