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SC-99

CAT: 1410-M16398-07Size: 200 mgDry Ice: NoHazardous: No
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CAT#:1410-M16398-07Size:200 mg
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Description
A novel selective STAT3 inhibitor that inhibits JAK2-STAT3 activation.
CAS Number
882290-02-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
336.147
Molecular Formula
C15H8Cl2FN3O
Notes
Research use only, not for human use.
Receptor
STAT

Chemical Information

Propionitrile, 2-[(3-chloro-4-fluorophenyl)hydrazono]-3-(4-chlorophenyl)-3-oxo-
CAS Number882290-02-0
PubChem CID5896323
IUPAC Name(1E)-N-(3-chloro-4-fluoroanilino)-2-(4-chlorophenyl)-2-oxoethanimidoyl cyanide
Molecular FormulaC15H8Cl2FN3O
Molecular Weight336.1
XLogP6.3
Topological Polar Surface Area65.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity482
SMILES
C1=CC(=CC=C1C(=O)/C(=N/NC2=CC(=C(C=C2)F)Cl)/C#N)Cl
InChI
InChI=1S/C15H8Cl2FN3O/c16-10-3-1-9(2-4-10)15(22)14(8-19)21-20-11-5-6-13(18)12(17)7-11/h1-7,20H/b21-14+
InChIKey
ZKULFSMYRSFHKE-KGENOOAVSA-N
Chemical Structure
2D Structure
2D structure of Propionitrile, 2-[(3-chloro-4-fluorophenyl)hydrazono]-3-(4-chlorophenyl)-3-oxo-
CAS: 882290-02-0
CID: 5896323
Formula: C15H8Cl2FN3O
MW: 336.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight336.1
XLogP36.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass335.0028454
Monoisotopic Mass335.0028454
Topological Polar Surface Area65.3 Ų
Heavy Atom Count22
Formal Charge0
Complexity482
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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