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MTX-216

CAT: 0804-HY-156872Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-156872Size:1 Each
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Description
MTX-216 is a dual ATP-competitive inhibitor of PI3K and EGFR. MTX-216 cosuppresses Ki-67 and ribosomal S6 phosphorylation and induces apoptosis in NF1LOF cells. MTX-216 suppresses the activity of SYK kinase, with an IC50 of 281 nM. MTX-216 is used in the research of Melanoma[1].
CAS Number
1952236-19-9
UNSPSC
12352005
Target
Apoptosis; EGFR; PI3K; Syk
Related Pathways
Apoptosis; JAK/STAT Signaling; PI3K/Akt/mTOR; Protein Tyrosine Kinase/RTK
Field of Research
Cancer
Smiles
N#CC1=C(NC2=CC=C(C(Cl)=C2)F)C3=CC(C4=CC(NS(=O)(C)=O)=C(Cl)N=C4)=CC=C3N=C1
Molecular Formula
C22H14Cl2FN5O2S
Molecular Weight
502.35
References & Citations
[1]Cara Abecunas, et al. Loss of NF1 in Melanoma Confers Sensitivity to SYK Kinase Inhibition. Cancer Res. 2023 Jan 18;83 (2) :316-331.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

N-(2-chloro-5-(4-((3-chloro-4-fluorophenyl)amino)-3-cyanoquinolin-6-yl)pyridin-3-yl)methanesulfonamide
CAS Number1952236-19-9
PubChem CID121416263
IUPAC NameN-[2-chloro-5-[4-(3-chloro-4-fluoroanilino)-3-cyanoquinolin-6-yl]-3-pyridinyl]methanesulfonamide
Molecular FormulaC22H14Cl2FN5O2S
Molecular Weight502.3
XLogP5.2
Topological Polar Surface Area116
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Heavy Atom Count33
Formal Charge0
Complexity836
SMILES
CS(=O)(=O)NC1=C(N=CC(=C1)C2=CC3=C(C(=CN=C3C=C2)C#N)NC4=CC(=C(C=C4)F)Cl)Cl
InChI
InChI=1S/C22H14Cl2FN5O2S/c1-33(31,32)30-20-7-13(10-28-22(20)24)12-2-5-19-16(6-12)21(14(9-26)11-27-19)29-15-3-4-18(25)17(23)8-15/h2-8,10-11,30H,1H3,(H,27,29)
InChIKey
WEVXFHBMHZDTAQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2-chloro-5-(4-((3-chloro-4-fluorophenyl)amino)-3-cyanoquinolin-6-yl)pyridin-3-yl)methanesulfonamide
CAS: 1952236-19-9
CID: 121416263
Formula: C22H14Cl2FN5O2S
MW: 502.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight502.3
XLogP35.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Exact Mass501.0229294
Monoisotopic Mass501.0229294
Topological Polar Surface Area116 Ų
Heavy Atom Count33
Formal Charge0
Complexity836
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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