imibenconazole

Identification (Source:EPA,EU)

ID 541
Name imibenconazole
CAS 86598-92-7
IUPAC
Inchi InChI=1S/C17H13Cl3N4S/c18-13-3-1-12(2-4-13)9-25-17(8-24-11-21-10-22-24)23-16-6-5-14(19)7-15(16)20/h1-7,10-11H,8-9H2
CIPAC None allocated
EPA Code
Formula C17H13Cl3N4S
SMILES Clc3ccc(/N=C(\SCc1ccc(Cl)cc1)Cn2ncnc2)c(Cl)c3
Status Not Approved

Classification

Mode of Action Systemic with curative and preventative action
Pesticide Type Fungicide
Chemical Group Triazole
Classification conazole fungicides (triazoles)

Properties (Source:PubChem)

Molecular Weight 411.7
Physical State Pale yellow crystals
AlogP 5.475
H-Bond Donor 0
H-Bond Acceptor 4
Surface Area 367.43
Polar Surface Area 68.37

Structure



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3D similarity method

2D similarity method

Compound Database



Bioactivity Database

KEGG (5,928)

PDB (7,072)


Similarity Threshold

Ecotoxicology (Source:PPDB,IPM)

Species Method Study Time Dose Type Value
Algae Acute 72 hour EC50, growth 1000 mg l-1
Aquatic invertebrates Acute 48 hour EC50 100 mg l-1
Birds Acute LD50 2250 mg kg-1
Earthworms Acute 14 day LD50 1000 mg kg-1
Fish Acute 96 hour LC50 0.67 mg l-1
Honeybees Acute 48 hour LD50 125 μg bee-1
Mammals Acute oral LD50 > 2800 mg kg-1
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