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Tinengotinib

CAT: 0013-GTR19189314-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19189314-01Size:1 mg
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Description
Tinengotinib
CAS Number
2230490-29-4
Product Name Alternative
Tinengotinib, TT00420, TT 00420
Field of Research
Cardiovascular Research, Cell Biology, Epigenetics & Chromatin, Signal Transduction, Stem Cell & Developmental Biology
Purity
99.05% (May vary between batches)
Solubility
DMSO:25 mg/mL (63.31 mM)
Smiles
ClC=1C=CC=CC1C2=NC=3C (=NNC3C) NC=4C=C (N=CC24) N5CCOCC5
Molecular Formula
C20H19ClN6O
Molecular Weight
394.86
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Tinengotinib

Tinengotinib is an orally available small molecule inhibitor of Aurora kinases (AKs) A and B, Janus kinases (JAKs), fibroblast growth factor receptors (FGFRs) and vascular endothelial growth factor receptors (VEGFRs), with potential antineoplastic and immunomodulatory activities. Upon oral administration, tinengotinib selectively binds to and inhibits AKs A and B, which inhibit cell division in tumor cells that overexpress AKs. Tinengotinib also targets JAKs that are involved in cytokine signaling and inflammation, and FGFRs and VEGFRs, which are overexpressed in the microenvironment (TME) and contribute to neovascularization, tumor growth and metastasis. These kinases are overexpressed by a wide variety of cancer cell types and drive tumor cell proliferation.

CAS Number2230490-29-4
PubChem CID137279257
IUPAC Name4-[9-(2-chlorophenyl)-6-methyl-2,4,5,8,12-pentazatricyclo[8.4.0.03,7]tetradeca-1(14),3,6,8,10,12-hexaen-13-yl]morpholine
Molecular FormulaC20H19ClN6O
Molecular Weight394.9
XLogP3.4
Topological Polar Surface Area78.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count28
Formal Charge0
Complexity585
SMILES
CC1=C2C(=NN1)NC3=CC(=NC=C3C(=N2)C4=CC=CC=C4Cl)N5CCOCC5
InChI
InChI=1S/C20H19ClN6O/c1-12-18-20(26-25-12)23-16-10-17(27-6-8-28-9-7-27)22-11-14(16)19(24-18)13-4-2-3-5-15(13)21/h2-5,10-11H,6-9H2,1H3,(H2,23,25,26)
InChIKey
DQFCVOOFMXEPOC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tinengotinib
CAS: 2230490-29-4
CID: 137279257
Formula: C20H19ClN6O
MW: 394.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight394.9
XLogP33.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass394.1308869
Monoisotopic Mass394.1308869
Topological Polar Surface Area78.4 Ų
Heavy Atom Count28
Formal Charge0
Complexity585
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

Alternative Products

CatalogName
BA3725-5Tinengotinib
A24167-10Tinengotinib (TT 00420) 10mg
A24167-5Tinengotinib (TT 00420) 5mg
A24167-100Tinengotinib (TT 00420) 100mg
A24167-50Tinengotinib (TT 00420) 50mg

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