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Aminopyrifen

CAT: 0931-T70483-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T70483-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1531626-08-0
Target
Others
Related Pathways
Others
Bioactivity
Aminopyrifen is a fungicide that inhibits GWT-1 protein in glycosylphosphatidylinositol-anchor biosynthesis in Neurospora crassa.
Smiles
C(OCC1=CC=C(OC2=CC=CC=C2)C=C1)(=O)C3=C(N)N=C(C)C=C3
Molecular Formula
C20H18N2O3
Molecular Weight
334.37
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Aminopyrifen
CAS Number1531626-08-0
PubChem CID91810812
IUPAC Name(4-phenoxyphenyl)methyl 2-amino-6-methylpyridine-3-carboxylate
Molecular FormulaC20H18N2O3
Molecular Weight334.4
XLogP4.3
Topological Polar Surface Area74.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count25
Formal Charge0
Complexity417
SMILES
CC1=NC(=C(C=C1)C(=O)OCC2=CC=C(C=C2)OC3=CC=CC=C3)N
InChI
InChI=1S/C20H18N2O3/c1-14-7-12-18(19(21)22-14)20(23)24-13-15-8-10-17(11-9-15)25-16-5-3-2-4-6-16/h2-12H,13H2,1H3,(H2,21,22)
InChIKey
PWWPULQZEAPTTB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Aminopyrifen
CAS: 1531626-08-0
CID: 91810812
Formula: C20H18N2O3
MW: 334.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight334.4
XLogP34.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass334.13174244
Monoisotopic Mass334.13174244
Topological Polar Surface Area74.4 Ų
Heavy Atom Count25
Formal Charge0
Complexity417
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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