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IQ 3

CAT: 0607-B9015-50Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0607-B9015-50Size:50 mg
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Description
Selective JNK3 inhibitor
CAS Number
312538-03-7
Product Name Alternative
(E)-11H-indeno[1,2-b]quinoxalin-11-one O-furan-2-carbonyl oxime
Field of Research
MAPK Signaling JNK
Form
Yellow solid
Solubility
<6.83mg/ml in DMSO
Smiles
O=C(O/N=C1C2=CC=CC=C2C3=NC4=CC=CC=C4N=C3\1)C5=CC=CO5
Molecular Formula
C20H11N3O3
Molecular Weight
341.32
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

[(E)-indeno[1,2-b]quinoxalin-11-ylideneamino] furan-2-carboxylate
CAS Number312538-03-7
PubChem CID5405540
IUPAC Name[(E)-indeno[1,2-b]quinoxalin-11-ylideneamino] furan-2-carboxylate
Molecular FormulaC20H11N3O3
Molecular Weight341.3
XLogP4.1
Topological Polar Surface Area77.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count26
Formal Charge0
Complexity581
SMILES
C1=CC=C\2C(=C1)C3=NC4=CC=CC=C4N=C3/C2=N/OC(=O)C5=CC=CO5
InChI
InChI=1S/C20H11N3O3/c24-20(16-10-5-11-25-16)26-23-18-13-7-2-1-6-12(13)17-19(18)22-15-9-4-3-8-14(15)21-17/h1-11H/b23-18+
InChIKey
WBSWWONMTZEOGS-PTGBLXJZSA-N
Chemical Structure
2D Structure
2D structure of [(E)-indeno[1,2-b]quinoxalin-11-ylideneamino] furan-2-carboxylate
CAS: 312538-03-7
CID: 5405540
Formula: C20H11N3O3
MW: 341.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight341.3
XLogP34.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass341.08004122
Monoisotopic Mass341.08004122
Topological Polar Surface Area77.6 Ų
Heavy Atom Count26
Formal Charge0
Complexity581
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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