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7-Nitroindazole (sodium)

CAT: 0804-HY-69019ASize: 1 EachDry Ice: NoHazardous: No
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Description
7-Nitroindazole sodium is a selective and BBB-penetrable inhibitor of nitric oxide synthase (NOS) . 7-Nitroindazole sodium can inhibit the activity of central NOS with an IC50 of 0.47 μM in the cerebellum of mice. 7-Nitroindazole sodium has anti-injurious and neuroprotective properties[1][2].
CAS Number
161467-34-1
UNSPSC
12352005
Hazard Statement
H302-H315-H319-H335
Target
NO Synthase
Type
Reference compound
Related Pathways
Immunology/Inflammation
Applications
Neuroscience-Neuromodulation
Field of Research
Neurological Disease; Cardiovascular Disease
Assay Protocol
https://www.medchemexpress.com/7-nitroindazole-sodium.html
Smiles
O=[N+](C1=CC=CC2=C1[N-]N=C2)[O-].[Na+]
Molecular Formula
C7H4N3NaO2
Molecular Weight
185.12
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
References & Citations
[1]Moore PK, et al. 7-Nitro indazole, an inhibitor of nitric oxide synthase, exhibits anti-nociceptive activity in the mouse without increasing blood pressure. Br J Pharmacol. 1993 Feb;108 (2) :296-7.|[2]Moore PK, et al. Characterization of the novel nitric oxide synthase inhibitor 7-nitro indazole and related indazoles: antinociceptive and cardiovascular effects. Br J Pharmacol. 1993 Sep;110 (1) :219-24.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

7-Nitroindazole sodium salt
CAS Number161467-34-1
PubChem CID23661758
IUPAC Namesodium 7-nitroindazol-2-ide
Molecular FormulaC7H4N3NaO2
Molecular Weight185.12
Topological Polar Surface Area59.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count13
Formal Charge0
Complexity192
SMILES
C1=CC2=C[N-]N=C2C(=C1)[N+](=O)[O-].[Na+]
InChI
InChI=1S/C7H4N3O2.Na/c11-10(12)6-3-1-2-5-4-8-9-7(5)6;/h1-4H;/q-1;+1
InChIKey
DJMLKKIIBMJGIQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-Nitroindazole sodium salt
CAS: 161467-34-1
CID: 23661758
Formula: C7H4N3NaO2
MW: 185.12
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight185.12
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass185.02012066
Monoisotopic Mass185.02012066
Topological Polar Surface Area59.7 Ų
Heavy Atom Count13
Formal Charge0
Complexity192
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes