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Panidazole

CAT: 0013-GTR19202629-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19202629-01Size:2 mg
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Description
Panidazole is a small molecule compound with anti-amoebic properties, used in research to study parasitic infections. It is applicable in both in vitro assays and in vivo experimental models for investigating amoebicidal mechanisms and potential therapeutic interventions.
CAS Number
13752-33-5
Field of Research
Infectious Disease & Virology
Smiles
Cc1ncc (n1CCc1ccncc1) [N+] ([O-]) =O
Molecular Formula
C11H12N4O2
Molecular Weight
232.24
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Panidazole

Panidazole is a small molecule drug. The usage of the INN stem '-nidazole' in the name indicates that Panidazole is a antiprotozoal and radiosensitizer, metronidazole derivative. Panidazole has a monoisotopic molecular weight of 232.1 Da.

CAS Number13752-33-5
PubChem CID72080
IUPAC Name4-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]pyridine
Molecular FormulaC11H12N4O2
Molecular Weight232.24
XLogP0.1
Topological Polar Surface Area76.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity263
SMILES
CC1=NC=C(N1CCC2=CC=NC=C2)[N+](=O)[O-]
InChI
InChI=1S/C11H12N4O2/c1-9-13-8-11(15(16)17)14(9)7-4-10-2-5-12-6-3-10/h2-3,5-6,8H,4,7H2,1H3
InChIKey
ARYPMCPJIWUCIP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Panidazole
CAS: 13752-33-5
CID: 72080
Formula: C11H12N4O2
MW: 232.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight232.24
XLogP30.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass232.09602564
Monoisotopic Mass232.09602564
Topological Polar Surface Area76.5 Ų
Heavy Atom Count17
Formal Charge0
Complexity263
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes