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AZ7550 Mesylate (Standard)

CAT: 0804-HY-B0794BR-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-B0794BR-01Size:1 mg
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Description
AZ7550 Mesylate (Standard) is the analytical standard of AZ7550 Mesylate. This product is intended for research and analytical applications. AZ7550 Mesylate is an active metabolite of AZD9291 and inhibits the activity of IGF1R with an IC50 of 1.6 μM.
CAS Number
2319837-99-3
Product Name Alternative
AZ7550 trimesylate salt (Standard)
UNSPSC
12352005
Target
Drug Metabolite; EGFR; IGF-1R; Reference Standards
Related Pathways
JAK/STAT Signaling; Metabolic Enzyme/Protease; Others; Protein Tyrosine Kinase/RTK
Field of Research
Cancer; Endocrinology
Smiles
CN1C=C(C2=NC(NC3=CC(NC(C=C)=O)=C(N(CCNC)C)C=C3OC)=NC=C2)C4=CC=CC=C41.O=S(O)(C)=O.O=S(O)(C)=O.O=S(O)(C)=O
Molecular Formula
C30H43N7O11S3
Molecular Weight
773.90
References & Citations
[1]Finlay MR, et al. Discovery of a potent and selective EGFR inhibitor (AZD9291) of both sensitizing and T790M resistance mutations that spares the wild type form of the receptor. J Med Chem. 2014 Oct 23;57 (20) :8249-67.
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

AZ7550 Mesylate
CAS Number2319837-99-3
PubChem CID134611624
IUPAC Namemethanesulfonic acid;N-[4-methoxy-5-[[4-(1-methylindol-3-yl)pyrimidin-2-yl]amino]-2-[methyl-[2-(methylamino)ethyl]amino]phenyl]prop-2-enamide
Molecular FormulaC30H43N7O11S3
Molecular Weight773.9
Topological Polar Surface Area285
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count16
Rotatable Bond Count10
Heavy Atom Count51
Formal Charge0
Complexity817
SMILES
CNCCN(C)C1=CC(=C(C=C1NC(=O)C=C)NC2=NC=CC(=N2)C3=CN(C4=CC=CC=C43)C)OC.CS(=O)(=O)O.CS(=O)(=O)O.CS(=O)(=O)O
InChI
InChI=1S/C27H31N7O2.3CH4O3S/c1-6-26(35)30-21-15-22(25(36-5)16-24(21)33(3)14-13-28-2)32-27-29-12-11-20(31-27)19-17-34(4)23-10-8-7-9-18(19)23;3*1-5(2,3)4/h6-12,15-17,28H,1,13-14H2,2-5H3,(H,30,35)(H,29,31,32);3*1H3,(H,2,3,4)
InChIKey
AZRGPJKRGFXCLD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of AZ7550 Mesylate
CAS: 2319837-99-3
CID: 134611624
Formula: C30H43N7O11S3
MW: 773.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight773.9
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count16
Rotatable Bond Count10
Exact Mass773.21826873
Monoisotopic Mass773.21826873
Topological Polar Surface Area285 Ų
Heavy Atom Count51
Formal Charge0
Complexity817
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count4
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
471052AZ7550 Mesylate
BUP01438-01AZ7550
A12008-1AZ7550 1mg
A12008-25AZ7550 25mg
A12008-10AZ7550 10mg
M26549-01AZ7550 hydrochloride
A12008-50AZ7550 50mg
A12008-100AZ7550 100mg
A12008-5AZ7550 5mg
T13564L2AZ7550 trimesylate salt

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