ChemicalBook--->CAS DataBase List--->1436861-97-0

1436861-97-0

1436861-97-0 Structure

1436861-97-0 Structure
IdentificationBack Directory
[Name]

Zidebactam
[CAS]

1436861-97-0
[Synonyms]

Zidebactam
(2S,5R)-7-oxo-6-(sulfooxy)-1,6-diazabicyclo[3.2.1] octane-2-carboxylic acid, 2-[2-[(3R)-3-piperidinylcarbonyl]hydrazide ]
1,6-Diazabicyclo[3.2.1]octane-2-carboxylic acid, 7-oxo-6-(sulfooxy)-, 2-[2-[(3R)-3-piperidinylcarbonyl]hydrazide], (1R,2S,5R)-
[Molecular Formula]

C13H21N5O7S
[MDL Number]

MFCD32062794
[MOL File]

1436861-97-0.mol
[Molecular Weight]

391.4
Chemical PropertiesBack Directory
[density ]

1?+-.0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO:250.0(Max Conc. mg/mL);638.73(Max Conc. mM)
Water:50.0(Max Conc. mg/mL);127.75(Max Conc. mM)
[form ]

A solid
[pka]

-4.59±0.18(Predicted)
[color ]

White to yellow
[InChI]

InChI=1/C13H21N5O7S/c19-11(8-2-1-5-14-6-8)15-16-12(20)10-4-3-9-7-17(10)13(21)18(9)25-26(22,23)24/h8-10,14H,1-7H2,(H,15,19)(H,16,20)(H,22,23,24)/t8-,9-,10+/s3
[InChIKey]

YCZPXRQPDCXTIO-GTUQAFHNNA-N
[SMILES]

C([C@@H]1CC[C@H]2N(OS(O)(=O)=O)C(=O)[N@@]1C2)(=O)NNC([C@H]1CNCCC1)=O |&1:1,4,13,19,r|
Hazard InformationBack Directory
[Uses]

Zidebactam is a useful raw material for pharmaceutical compositions containing antibacterial agents and their therapeutic uses.
[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

Zidebactam(1436861-97-0)1HNMR
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