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Insecticidal agent 10

CAT: 0931-T88264-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T88264-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3026314-21-3
Target
Parasite
Related Pathways
Microbiology/Virology
Bioactivity
Insecticidal Agent 10 (Compound 8c) serves as a chitinase inhibitor, effectively targeting OfChi-h and OfChtI with IC 50 values of 1.51 and 9.21 nM, respectively. Additionally, it restricts the growth of Ostrinia furnacalis, exhibiting an LC 50 of 22.14 mg/L.
Smiles
O=C(NC(=N)NCCCN1C(=O)C=2C=CC=C3C=CC=C(C1=O)C32)NC
Molecular Formula
C18H19N5O3
Molecular Weight
353.38
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Insecticidal agent 10
CAS Number3026314-21-3
PubChem CID171714297
IUPAC Name1-[N'-[3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propyl]carbamimidoyl]-3-methylurea
Molecular FormulaC18H19N5O3
Molecular Weight353.4
XLogP1.5
Topological Polar Surface Area117
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity576
SMILES
CNC(=O)NC(=NCCCN1C(=O)C2=CC=CC3=C2C(=CC=C3)C1=O)N
InChI
InChI=1S/C18H19N5O3/c1-20-18(26)22-17(19)21-9-4-10-23-15(24)12-7-2-5-11-6-3-8-13(14(11)12)16(23)25/h2-3,5-8H,4,9-10H2,1H3,(H4,19,20,21,22,26)
InChIKey
VNMWGTRFSKDYBH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Insecticidal agent 10
CAS: 3026314-21-3
CID: 171714297
Formula: C18H19N5O3
MW: 353.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight353.4
XLogP31.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass353.14878949
Monoisotopic Mass353.14878949
Topological Polar Surface Area117 Ų
Heavy Atom Count26
Formal Charge0
Complexity576
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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