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Fenamidone

CAT: 0013-GTR19209597-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19209597-02Size:50 mg
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Description
Fenamidone
CAS Number
161326-34-7
Field of Research
Metabolism Research
Smiles
C[C@@]1 (C (=O) N (NC2=CC=CC=C2) C (SC) =N1) C3=CC=CC=C3
Molecular Formula
C17H17N3OS
Molecular Weight
311.4
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Fenamidone

Fenamidone is a member of the class of imidazolones that is 3,5-dihydroimidazol-4-one substituted at position 2 by a methylthiogroup, at position 3 by an anilino group and at position 5 by phenyl and methyl groups (the S-enantiomer). A fungicide effective against Oomycete diseases such as downy mildew and certain leaf spot diseases. It has a role as a quinone outside inhibitor, a mitochondrial cytochrome-bc1 complex inhibitor and an antifungal agrochemical. It is an organic sulfide, an imidazolone, a carbohydrazide and an imidazole fungicide.

CAS Number161326-34-7
PubChem CID10403199
IUPAC Name(5S)-3-anilino-5-methyl-2-methylsulfanyl-5-phenylimidazol-4-one
Molecular FormulaC17H17N3OS
Molecular Weight311.4
XLogP4.1
Topological Polar Surface Area70
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity441
SMILES
C[C@@]1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1
InChIKey
LMVPQMGRYSRMIW-KRWDZBQOSA-N
Chemical Structure
2D Structure
2D structure of Fenamidone
CAS: 161326-34-7
CID: 10403199
Formula: C17H17N3OS
MW: 311.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight311.4
XLogP34.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass311.10923335
Monoisotopic Mass311.10923335
Topological Polar Surface Area70 Ų
Heavy Atom Count22
Formal Charge0
Complexity441
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T70383-01Fenamidone
TRC-F245402-100MGFenamidone-d3
CS-I-00514Fenamidone-[13C6]
TRC-F245403-50MGFenamidone Metabolite
HY-133186RFenamidone (Standard)
LCS-49661000 ug/mL Fenamidone in HPLC Acetonitrile - 1ML
S-4966-ACN1000 ug/mL Fenamidone in Acetonitrile Volume: 1mL Ampule - 1ML

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