NAV

Niridazole

This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.

Identification

Generic Name
Niridazole
DrugBank Accession Number
DB13661
Background

Not Available

Type
Small Molecule
Groups
Experimental
Structure
3D
Similar Structures
Weight
Average: 214.2
Monoisotopic: 214.016061243
Chemical Formula
C6H6N4O3S
Synonyms
  • Niridazol
  • Niridazole
  • Niridazolum
External IDs
  • BA 32644
  • BA 32644 Ciba
  • CIBA 32644BA
  • NSC-136947
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Pharmacology

Indication

Not Available

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Contraindications & Blackbox Warnings
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Pharmacodynamics

Not Available

Mechanism of action
Not Available
Absorption

Not Available

Volume of distribution

Not Available

Protein binding

Not Available

Metabolism
Not Available
Route of elimination

Not Available

Half-life

Not Available

Clearance

Not Available

Adverse Effects
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Toxicity

Not Available

Pathways
Not Available
Pharmacogenomic Effects/ADRs
Not Available

Interactions

Drug Interactions
This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.
Not Available
Food Interactions
Not Available

Categories

ATC Codes
P02BX02 — Niridazole
Drug Categories
Chemical TaxonomyProvided by Classyfire
Description
This compound belongs to the class of organic compounds known as nitrothiazoles. These are compounds containing a thiazole ring which bears a nitro group.
Kingdom
Organic compounds
Super Class
Organoheterocyclic compounds
Class
Azoles
Sub Class
Thiazoles
Direct Parent
Nitrothiazoles
Alternative Parents
Nitroaromatic compounds / 2,5-disubstituted thiazoles / Imidazolidinones / Heteroaromatic compounds / Ureas / Propargyl-type 1,3-dipolar organic compounds / Organic oxoazanium compounds / Azacyclic compounds / Organopnictogen compounds / Organonitrogen compounds
show 3 more
Substituents
2,5-disubstituted 1,3-thiazole / Allyl-type 1,3-dipolar organic compound / Aromatic heteromonocyclic compound / Azacycle / C-nitro compound / Carbonic acid derivative / Carbonyl group / Heteroaromatic compound / Hydrocarbon derivative / Imidazolidine
show 14 more
Molecular Framework
Aromatic heteromonocyclic compounds
External Descriptors
C-nitro compound, thiazoles (CHEBI:82349)
Affected organisms
Not Available

Chemical Identifiers

UNII
N116U8Y5QQ
CAS number
61-57-4
InChI Key
RDXLYGJSWZYTFJ-UHFFFAOYSA-N
InChI
InChI=1S/C6H6N4O3S/c11-5-7-1-2-9(5)6-8-3-4(14-6)10(12)13/h3H,1-2H2,(H,7,11)
IUPAC Name
1-(5-nitro-1,3-thiazol-2-yl)imidazolidin-2-one
SMILES
[O-][N+](=O)C1=CN=C(S1)N1CCNC1=O

References

General References
Not Available
KEGG Compound
C19268
ChemSpider
5868
ChEBI
82349
ChEMBL
CHEMBL152632
ZINC
ZINC000003875416
Wikipedia
Niridazole

Clinical Trials

Clinical Trials
PhaseStatusPurposeConditionsCount

Pharmacoeconomics

Manufacturers
Not Available
Packagers
Not Available
Dosage Forms
Not Available
Prices
Not Available
Patents
Not Available

Properties

State
Not Available
Experimental Properties
Not Available
Predicted Properties
PropertyValueSource
Water Solubility2.21 mg/mLALOGPS
logP0.3ALOGPS
logP0.24Chemaxon
logS-2ALOGPS
pKa (Strongest Acidic)15.52Chemaxon
pKa (Strongest Basic)-4.4Chemaxon
Physiological Charge0Chemaxon
Hydrogen Acceptor Count4Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area88.37 Å2Chemaxon
Rotatable Bond Count2Chemaxon
Refractivity45.8 m3·mol-1Chemaxon
Polarizability18.6 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon
Predicted ADMET Features
Not Available

Spectra

Mass Spec (NIST)
Not Available
Spectra
SpectrumSpectrum TypeSplash Key
Predicted 1H NMR Spectrum1D NMRNot Applicable
Predicted 13C NMR Spectrum1D NMRNot Applicable
Chromatographic Properties
Collision Cross Sections (CCS)
AdductCCS Value (Å2)Source typeSource
[M-H]-146.8622084
predicted
DarkChem Lite v0.1.0
[M-H]-134.71004
predicted
DeepCCS 1.0 (2019)
[M+H]+147.5476084
predicted
DarkChem Lite v0.1.0
[M+H]+138.53737
predicted
DeepCCS 1.0 (2019)
[M+Na]+147.2055084
predicted
DarkChem Lite v0.1.0
[M+Na]+147.84953
predicted
DeepCCS 1.0 (2019)

Drug created at June 23, 2017 20:46 / Updated at February 21, 2021 18:54