NAV

Tetramethrin

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

Identification

Generic Name
Tetramethrin
DrugBank Accession Number
DB13752
Background

Not Available

Type
Small Molecule
Groups
Experimental
Structure
3D
Similar Structures
Weight
Average: 331.4061
Monoisotopic: 331.178358293
Chemical Formula
C19H25NO4
Synonyms
  • Tetramethrin
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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 Browse all" title="About SNP Mediated Effects/ADRs" id="snp-actions-info" class="drug-info-popup" href="javascript:void(0);">
Not Available

Interactions

Drug Interactions Learn More" title="About Drug Interactions" id="structured-interactions-info" class="drug-info-popup" href="javascript:void(0);">
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
P03BA04 — Tetramethrin
Drug Categories
Chemical TaxonomyProvided by Classyfire
Description
This compound belongs to the class of organic compounds known as isoindolones. These are aromatic polycyclic compounds that an isoindole bearing a ketone.
Kingdom
Organic compounds
Super Class
Organoheterocyclic compounds
Class
Isoindoles and derivatives
Sub Class
Isoindolines
Direct Parent
Isoindolones
Alternative Parents
Bicyclic monoterpenoids / Isoindoles / Maleimides / Cyclopropanecarboxylic acids and derivatives / N-substituted carboxylic acid imides / Pyrrolines / Dicarboximides / Carboxylic acid esters / Lactams / Azacyclic compounds
show 6 more
Substituents
Aliphatic heteropolycyclic compound / Azacycle / Bicyclic monoterpenoid / Carbonyl group / Carboxylic acid derivative / Carboxylic acid ester / Carboxylic acid imide / Carboxylic acid imide, n-substituted / Cyclopropanecarboxylic acid or derivatives / Dicarboximide
show 14 more
Molecular Framework
Aliphatic heteropolycyclic compounds
External Descriptors
cyclopropanes, phthalimide insecticide (CHEBI:39397) / Pyrethroid insecticides (C18373)
Affected organisms
Not Available

Chemical Identifiers

UNII
Z72930Q46K
CAS number
7696-12-0
InChI Key
CXBMCYHAMVGWJQ-UHFFFAOYSA-N
InChI
InChI=1S/C19H25NO4/c1-11(2)9-14-15(19(14,3)4)18(23)24-10-20-16(21)12-7-5-6-8-13(12)17(20)22/h9,14-15H,5-8,10H2,1-4H3
IUPAC Name
(1,3-dioxo-2,3,4,5,6,7-hexahydro-1H-isoindol-2-yl)methyl 2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropane-1-carboxylate
SMILES
CC(C)=CC1C(C(=O)OCN2C(=O)C3=C(CCCC3)C2=O)C1(C)C

References

General References
Not Available
KEGG Compound
C18373
ChemSpider
75773
ChEBI
39397
ChEMBL
CHEMBL1788386
Wikipedia
Tetramethrin

Clinical Trials

Clinical Trials Learn More" title="About Clinical Trials" id="clinical-trials-info" class="drug-info-popup" href="javascript:void(0);">
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 Solubility0.0754 mg/mLALOGPS
logP2.84ALOGPS
logP3.09Chemaxon
logS-3.6ALOGPS
pKa (Strongest Basic)-4.1Chemaxon
Physiological Charge0Chemaxon
Hydrogen Acceptor Count3Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area63.68 Å2Chemaxon
Rotatable Bond Count5Chemaxon
Refractivity90.19 m3·mol-1Chemaxon
Polarizability36.73 Å3Chemaxon
Number of Rings3Chemaxon
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 MS/MS Spectrum - 10V, Positive (Annotated)Predicted LC-MS/MSsplash10-001i-5946000000-efc594356155ad0c882e
Predicted MS/MS Spectrum - 10V, Negative (Annotated)Predicted LC-MS/MSsplash10-001j-0907000000-4a5230eb90c61e3f2120
Predicted MS/MS Spectrum - 20V, Positive (Annotated)Predicted LC-MS/MSsplash10-08gl-3940000000-885ace69fd221d4ff728
Predicted MS/MS Spectrum - 20V, Negative (Annotated)Predicted LC-MS/MSsplash10-0uk9-0900000000-9b18381ee3cc4b7d6481
Predicted MS/MS Spectrum - 40V, Negative (Annotated)Predicted LC-MS/MSsplash10-001i-2911000000-e9e5695e5b09ef4a9a52
Predicted MS/MS Spectrum - 40V, Positive (Annotated)Predicted LC-MS/MSsplash10-0903-4920000000-f96425404045250c72d6
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]-178.66393
predicted
DeepCCS 1.0 (2019)
[M+H]+181.02194
predicted
DeepCCS 1.0 (2019)
[M+Na]+188.0501
predicted
DeepCCS 1.0 (2019)

Drug created at June 23, 2017 20:47 / Updated at February 21, 2021 18:54