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FLT3-IN-33

CAT: 0804-HY-174911Size: 1 EachDry Ice: NoHazardous: No
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Description
FLT3-IN-33 (Compound 7r) is a FLT3 inhibitor with an IC50 of 7.82 nM. FLT3-IN-33 has superior anticancer activities against acute myeloid leukemia (AML) cells, such as MV4-11 and MOLM-13 cells. FLT3-IN-33 significantly induces cell apoptosis and inhibits phosphorylation of FLT3 pathways. FLT3-IN-33 can be used for AML and other cancers research[1].
CAS Number
3035801-67-0
UNSPSC
12352005
Target
Apoptosis; FLT3
Related Pathways
Apoptosis; Protein Tyrosine Kinase/RTK
Field of Research
Cancer
Smiles
CN1CCN(C2=CC=C3C(N=C(C4=CN=C(NCCC)N=C4N[C@@H]5CC[C@@H](O)CC5)N3)=C2)CC1
Molecular Formula
C25H36N8O
Molecular Weight
464.61
References & Citations
[1]Du K, et al. Design, Synthesis, and Biological Evaluation of Potent FLT3 Inhibitor for Acute Myeloid Leukemia (AML) Treatment. Drug Dev Res. 2025 Aug;86 (5) :e70119.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Flt3-IN-33
CAS Number3035801-67-0
PubChem CID175562025
IUPAC Name4-[[5-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-2-(propylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol
Molecular FormulaC25H36N8O
Molecular Weight464.6
XLogP3.5
Topological Polar Surface Area105
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Heavy Atom Count34
Formal Charge0
Complexity624
SMILES
CCCNC1=NC=C(C(=N1)NC2CCC(CC2)O)C3=NC4=C(N3)C=C(C=C4)N5CCN(CC5)C
InChI
InChI=1S/C25H36N8O/c1-3-10-26-25-27-16-20(23(31-25)28-17-4-7-19(34)8-5-17)24-29-21-9-6-18(15-22(21)30-24)33-13-11-32(2)12-14-33/h6,9,15-17,19,34H,3-5,7-8,10-14H2,1-2H3,(H,29,30)(H2,26,27,28,31)
InChIKey
MIITVNWFBUGXSL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Flt3-IN-33
CAS: 3035801-67-0
CID: 175562025
Formula: C25H36N8O
MW: 464.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight464.6
XLogP33.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Exact Mass464.30120780
Monoisotopic Mass464.30120780
Topological Polar Surface Area105 Ų
Heavy Atom Count34
Formal Charge0
Complexity624
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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