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Chemical structure of Chitin synthase inhibitor 4

GC68860

Chitin synthase inhibitor 4

Also known as 2-[6-(3,4-dihydro-2H-quinolin-1-yl)-5-fluoropyrimidin-4-yl]oxybenzonitrile

Chitin synthase inhibitor 4 (compound 4fh) is a chitin synthase (CHS) inhibitor with fungicidal properties· Chitin synthase inhibitor 4 is a potential CHS-based agricultural fungicide

ChemicalCAS2755847-31-3MW346.36FormulaC20H15FN4O
CAS number
2755847-31-3
Molecular weight
346.36
Formula
C20H15FN4O
Solubility
DMSO ： 100 mg/mL (288·72 mM; Need ultrasonic)
InChIKey
NBUUFZOGDLIBJX-UHFFFAOYSA-N
Catalogue number
GC68860
Brand
GLPBIO
Computed properties PubChem CID 164886638 · XLogP 4.3 · TPSA 62 Ų · H-bond donors 0
XLogP
4.3
TPSA
62 Ų
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
26

SMILES C1CC2=CC=CC=C2N(C1)C3=C(C(=NC=N3)OC4=CC=CC=C4C#N)F

Computed descriptors from PubChem (CID 164886638), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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