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CIDD-8633

CAT: 0931-T211418-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T211418-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1428356-95-9
Target
Interleukin, Apoptosis, Caspase, Discoidin Domain Receptor (DDR)
Related Pathways
Tyrosine Kinase/Adaptors, Apoptosis, Proteases/Proteasome, Immunology/Inflammation
Bioactivity
CIDD-8633 is a potent inhibitor of DDR2 with an IC50 of 6.105 μM. It significantly suppresses the proliferation of MIA-PaCa-2 and AsPC-1 cells, with IC25 values of 4.0 and 5.5 μM, respectively. Additionally, CIDD-8633 hinders cell migration, arrests the cell cycle, induces apoptosis (apoptosis), and substantially reduces the growth of pancreatic ductal adenocarcinoma (PDAC) tumors. This compound is applicable in pancreatic cancer research, including studies on PDAC.
Smiles
O=C(NC1=CC=C(C=C1)NC2=NC(=NC(=C2)C)NCC)COC3=NN=C(C=C3)N4N=CC=C4
Molecular Formula
C22H23N9O2
Molecular Weight
445.48
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-((6-(1H-pyrazol-1-yl)pyridazin-3-yl)oxy)-N-(4-((2-(ethylamino)-6-methylpyrimidin-4-yl)amino)phenyl)acetamide
CAS Number1428356-95-9
PubChem CID71799699
IUPAC NameN-[4-[[2-(ethylamino)-6-methylpyrimidin-4-yl]amino]phenyl]-2-(6-pyrazol-1-ylpyridazin-3-yl)oxyacetamide
Molecular FormulaC22H23N9O2
Molecular Weight445.5
XLogP2.6
Topological Polar Surface Area132
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count9
Heavy Atom Count33
Formal Charge0
Complexity604
SMILES
CCNC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)COC3=NN=C(C=C3)N4C=CC=N4)C
InChI
InChI=1S/C22H23N9O2/c1-3-23-22-25-15(2)13-18(28-22)26-16-5-7-17(8-6-16)27-20(32)14-33-21-10-9-19(29-30-21)31-12-4-11-24-31/h4-13H,3,14H2,1-2H3,(H,27,32)(H2,23,25,26,28)
InChIKey
QAXYRFPPXCWNFN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-((6-(1H-pyrazol-1-yl)pyridazin-3-yl)oxy)-N-(4-((2-(ethylamino)-6-methylpyrimidin-4-yl)amino)phenyl)acetamide
CAS: 1428356-95-9
CID: 71799699
Formula: C22H23N9O2
MW: 445.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight445.5
XLogP32.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count9
Exact Mass445.19747101
Monoisotopic Mass445.19747101
Topological Polar Surface Area132 Ų
Heavy Atom Count33
Formal Charge0
Complexity604
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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