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FLT3-IN-17

CAT: 0931-T63174-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T63174-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2758999-62-9
Target
FAK, FLT, Cytochromes P450, Others
Related Pathways
Others, Angiogenesis, Tyrosine Kinase/Adaptors, Metabolism, Cytoskeletal Signaling
Bioactivity
FLT3-IN-17 is an FAK inhibitor (IC50: 12 nM) . FLT3-IN-17 inhibits the activity of CYPs and FLT3 mutants and has an IC50 of <0.5 nM for D835Y. FLT3-IN-17 can be used in cancer research.
Smiles
N(C=1N=C2C(=CSC2=CN1)C3=CC(NS(C)(=O)=O)=CC=C3)C4=CC=C(C=C4)N5CCNCC5
Molecular Formula
C23H24N6O2S2
Molecular Weight
480.61
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Flt3-IN-17
CAS Number2758999-62-9
PubChem CID164627080
IUPAC NameN-[3-[2-(4-piperazin-1-ylanilino)thieno[3,2-d]pyrimidin-7-yl]phenyl]methanesulfonamide
Molecular FormulaC23H24N6O2S2
Molecular Weight480.6
XLogP3.2
Topological Polar Surface Area136
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count6
Heavy Atom Count33
Formal Charge0
Complexity736
SMILES
CS(=O)(=O)NC1=CC=CC(=C1)C2=CSC3=CN=C(N=C32)NC4=CC=C(C=C4)N5CCNCC5
InChI
InChI=1S/C23H24N6O2S2/c1-33(30,31)28-18-4-2-3-16(13-18)20-15-32-21-14-25-23(27-22(20)21)26-17-5-7-19(8-6-17)29-11-9-24-10-12-29/h2-8,13-15,24,28H,9-12H2,1H3,(H,25,26,27)
InChIKey
MGKRFMQUFDKUBA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Flt3-IN-17
CAS: 2758999-62-9
CID: 164627080
Formula: C23H24N6O2S2
MW: 480.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight480.6
XLogP33.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count6
Exact Mass480.14021638
Monoisotopic Mass480.14021638
Topological Polar Surface Area136 Ų
Heavy Atom Count33
Formal Charge0
Complexity736
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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