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EBI-1051

CAT: 0013-GTR19203387-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19203387-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
EBI-1051 is a potent, orally bioavailable small molecule MEK inhibitor with an IC50 of 3.9 nM. It is a valuable research tool for investigating the MAPK/ERK pathway in cancer and inflammatory disease models, demonstrating efficacy in both cellular assays and in vivo studies.
CAS Number
1801896-05-8
Field of Research
Signal Transduction
Smiles
N (C1=C (C (NOC (CO) CO) =O) C=C2C (=C1F) OC=C2) C3=C (F) C=C (I) C=C3
Molecular Formula
C18H15F2IN2O5
Molecular Weight
504.22
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-((1,3-Dihydroxypropan-2-yl)oxy)-7-fluoro-6-((2-fluoro-4-iodophenyl)amino)benzofuran-5-carboxamide
CAS Number1801896-05-8
PubChem CID137628642
IUPAC NameN-(1,3-dihydroxypropan-2-yloxy)-7-fluoro-6-(2-fluoro-4-iodoanilino)-1-benzofuran-5-carboxamide
Molecular FormulaC18H15F2IN2O5
Molecular Weight504.2
XLogP3.3
Topological Polar Surface Area104
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Heavy Atom Count28
Formal Charge0
Complexity530
SMILES
C1=CC(=C(C=C1I)F)NC2=C(C=C3C=COC3=C2F)C(=O)NOC(CO)CO
InChI
InChI=1S/C18H15F2IN2O5/c19-13-6-10(21)1-2-14(13)22-16-12(18(26)23-28-11(7-24)8-25)5-9-3-4-27-17(9)15(16)20/h1-6,11,22,24-25H,7-8H2,(H,23,26)
InChIKey
VUJYNHRRRJUAHQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-((1,3-Dihydroxypropan-2-yl)oxy)-7-fluoro-6-((2-fluoro-4-iodophenyl)amino)benzofuran-5-carboxamide
CAS: 1801896-05-8
CID: 137628642
Formula: C18H15F2IN2O5
MW: 504.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight504.2
XLogP33.3
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Exact Mass503.99938
Monoisotopic Mass503.99938
Topological Polar Surface Area104 Ų
Heavy Atom Count28
Formal Charge0
Complexity530
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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