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FGFR2-IN-1

CAT: 0804-HY-145230-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-145230-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
FGFR2-IN-1 is a selective FGFR2 inhibitor with an IC50 of 140 nM.
CAS Number
2677709-76-9
UNSPSC
12352005
Target
FGFR
Type
Reference compound
Related Pathways
Protein Tyrosine Kinase/RTK
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/fgfr2-in-1.html
Purity
99.78
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
O=C(NC1=NNC2=C1C=CC(C3=CC=CC(OCC)=C3)=C2)C4=CC=CC=C4
Molecular Formula
C22H19N3O2
Molecular Weight
357.41
References & Citations
[1]Turner LD, et al. From Fragment to Lead: De Novo Design and Development toward a Selective FGFR2 Inhibitor. J. Med. Chem. 2021 Nov 15.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, protect from light)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Fgfr2-IN-1
CAS Number2677709-76-9
PubChem CID157049296
IUPAC NameN-[6-(3-ethoxyphenyl)-1H-indazol-3-yl]benzamide
Molecular FormulaC22H19N3O2
Molecular Weight357.4
XLogP4.7
Topological Polar Surface Area67
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count27
Formal Charge0
Complexity494
SMILES
CCOC1=CC=CC(=C1)C2=CC3=C(C=C2)C(=NN3)NC(=O)C4=CC=CC=C4
InChI
InChI=1S/C22H19N3O2/c1-2-27-18-10-6-9-16(13-18)17-11-12-19-20(14-17)24-25-21(19)23-22(26)15-7-4-3-5-8-15/h3-14H,2H2,1H3,(H2,23,24,25,26)
InChIKey
QKJLYUUEYRTLCL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fgfr2-IN-1
CAS: 2677709-76-9
CID: 157049296
Formula: C22H19N3O2
MW: 357.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight357.4
XLogP34.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass357.147726857
Monoisotopic Mass357.147726857
Topological Polar Surface Area67 Ų
Heavy Atom Count27
Formal Charge0
Complexity494
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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