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Pralurbactam

CAT: 0013-GTR19210153-02Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19210153-02Size:100 mg
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Description
Pralubactam is a β-lactamase inhibitor used in antibacterial research. It is employed in in vitro and in vivo studies to restore the efficacy of β-lactam antibiotics against resistant bacterial strains, particularly in models of Gram-negative infections.
CAS Number
2163782-59-8
Field of Research
Infectious Disease & Virology
Smiles
C (NOCCONC (=N) N) (=O) [C@H]1[N@@]2C (=O) N (OS (=O) (=O) O) [C@@] (C2) (CC1) [H]
Molecular Formula
C10H18N6O8S
Molecular Weight
382.35
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Pralurbactam

Pralurbactam is under investigation in clinical trial NCT06633718 (Study to Assess the Efficacy and Safety of Meropenem and Pralurbactam in CIAI).

CAS Number2163782-59-8
PubChem CID155048066
IUPAC Name[(2S,5R)-2-[2-(diaminomethylideneamino)oxyethoxycarbamoyl]-7-oxo-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate
Molecular FormulaC10H18N6O8S
Molecular Weight382.35
XLogP-2.5
Topological Polar Surface Area207
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count8
Heavy Atom Count25
Formal Charge0
Complexity644
SMILES
C1C[C@H](N2C[C@@H]1N(C2=O)OS(=O)(=O)O)C(=O)NOCCON=C(N)N
InChI
InChI=1S/C10H18N6O8S/c11-9(12)14-23-4-3-22-13-8(17)7-2-1-6-5-15(7)10(18)16(6)24-25(19,20)21/h6-7H,1-5H2,(H,13,17)(H4,11,12,14)(H,19,20,21)/t6-,7+/m1/s1
InChIKey
HOJIPBUGHMYVQD-RQJHMYQMSA-N
Chemical Structure
2D Structure
2D structure of Pralurbactam
CAS: 2163782-59-8
CID: 155048066
Formula: C10H18N6O8S
MW: 382.35
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight382.35
XLogP3-2.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count8
Exact Mass382.09068273
Monoisotopic Mass382.09068273
Topological Polar Surface Area207 Ų
Heavy Atom Count25
Formal Charge0
Complexity644
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T69856-01Pralurbactam

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