Products for Research Use Only

CFI-402257

CAT: 0013-GTR19202013-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19202013-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
CFI-402257 is a potent and selective Mps1/TTK kinase inhibitor (Mps1 Ki = 0.09 nM) . It is a valuable research tool for investigating hepatocellular carcinoma, with utility demonstrated in both in vitro cellular assays and in vivo tumor model studies.
CAS Number
1610759-22-2
Product Name Alternative
TTK, Mps1, CFI402257, CFI-402257, CFI 402257
Field of Research
Immunology & Inflammation, Signal Transduction
Purity
96.66% (May vary between batches)
Solubility
DMSO:37.7 mg/mL (75.61 mM)
Smiles
N (C[C@H]1C[C@@] (C) (O) C1) C=2N3C (=C (C=N3) C4=CC (C) =C (C (NC5CC5) =O) C=C4) N=C (OC=6C=CC=NC6) C2
Molecular Formula
C28H30N6O3
Molecular Weight
498.58
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Luvixasertib

See also: Luvixasertib (annotation moved to).

CAS Number1610759-22-2
PubChem CID118086034
IUPAC NameN-cyclopropyl-4-[7-[(3-hydroxy-3-methylcyclobutyl)methylamino]-5-pyridin-3-yloxypyrazolo[1,5-a]pyrimidin-3-yl]-2-methylbenzamide
Molecular FormulaC28H30N6O3
Molecular Weight498.6
XLogP3.6
Topological Polar Surface Area114
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Heavy Atom Count37
Formal Charge0
Complexity805
SMILES
CC1=C(C=CC(=C1)C2=C3N=C(C=C(N3N=C2)NCC4CC(C4)(C)O)OC5=CN=CC=C5)C(=O)NC6CC6
InChI
InChI=1S/C28H30N6O3/c1-17-10-19(5-8-22(17)27(35)32-20-6-7-20)23-16-31-34-24(30-14-18-12-28(2,36)13-18)11-25(33-26(23)34)37-21-4-3-9-29-15-21/h3-5,8-11,15-16,18,20,30,36H,6-7,12-14H2,1-2H3,(H,32,35)
InChIKey
PMQUGSPFUBGJCZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Luvixasertib
CAS: 1610759-22-2
CID: 118086034
Formula: C28H30N6O3
MW: 498.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight498.6
XLogP33.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Exact Mass498.23793884
Monoisotopic Mass498.23793884
Topological Polar Surface Area114 Ų
Heavy Atom Count37
Formal Charge0
Complexity805
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