CAS 16968-98-2

3-[(1S,2S,5R)-7-oxo-3-thia-6,8-diazabicyclo[3.3.0]oct-2-yl]propanoic acid

Description:

3-[(1S,2S,5R)-7-oxo-3-thia-6,8-diazabicyclo[3.3.0]oct-2-yl]propanoic acid, with the CAS number 16968-98-2, is a chemical compound characterized by its bicyclic structure, which includes both sulfur and nitrogen atoms. This compound features a propanoic acid moiety, indicating the presence of a carboxylic acid functional group, which contributes to its acidity and potential reactivity. The bicyclic framework suggests that it may exhibit unique stereochemical properties due to the specific arrangement of its chiral centers, which can influence its biological activity and interactions. The presence of the thia (sulfur-containing) and diaza (nitrogen-containing) components in the bicyclic structure may impart distinctive chemical properties, such as enhanced stability or specific binding affinities in biological systems. Overall, this compound may be of interest in medicinal chemistry and pharmacology, particularly in the development of novel therapeutic agents. Its specific characteristics, including solubility, melting point, and reactivity, would depend on the detailed molecular interactions and the environment in which it is studied.

Formula: C₈H₁₂N₂O₃S

InChI: InChI=1/C8H12N2O3S/c11-6(12)2-1-5-7-4(3-14-5)9-8(13)10-7/h4-5,7H,1-3H2,(H,11,12)(H2,9,10,13)/t4-,5-,7-/m0/s1

InChI key: InChIKey=QDFGCLSCEPNVQP-VPLCAKHXSA-N

SMILES: C(CC(O)=O)[C@H]1[C@@]2([C@](CS1)(NC(=O)N2)[H])[H]

Synonyms:

• (3aS,4S,6aR)-Hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-propanoic acid
• 1H-Thieno[3,4-d]imidazole-4-propanoic acid, hexahydro-2-oxo-, (3aS,4S,6aR)-
• 1H-Thieno[3,4-d]imidazole-4-propanoic acid, hexahydro-2-oxo-, [3aS-(3aα,4β,6aα)]-
• 1H-Thieno[3,4-d]imidazole-4-propionic acid, hexahydro-2-oxo-
• 3-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]propanoic acid
• Bisnorbiotin
• (3aS,6aβ)-Hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4α-propanoic acid
• 3-[(1S,2S,5R)-7-oxo-3-thia-6,8-diazabicyclo[3.3.0]oct-2-yl]propanoic acid

Bisnorbiotin

CAS: 16968-98-2

Formula: C₈H₁₂N₂O₃S

Molecular weight: 216.26

Ref: 4Z-B-155001

Bisnorbiotin

Controlled Product

CAS: 16968-98-2

Formula: C₈H₁₂N₂O₃S

Color and Shape: Neat

Molecular weight: 216.257

Ref: TR-B508800