Products for Research Use Only
RegisterLogin

Nek2-IN-6

CAT: 0804-HY-150046Size: 1 EachDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-150046Size:1 Each
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Nek2-IN-6 (Compound 28e) is a potent never in mitosis (NIMA) related kinase 2 (Nek2) inhibitor[1].
CAS Number
2410376-96-2
UNSPSC
12352005
Target
NEKs
Type
Reference compound
Related Pathways
Cell Cycle/DNA Damage
Applications
Cancer-Kinase/protease
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/nek2-in-6.html
Solubility
10 mM in DMSO
Smiles
CC(C1=CC=CC=C1C(F)(F)F)OC2=C(SC(C3=CN=C4C=C(C=CN34)C5=CN(N=C5)CC6CN(C6)C(OC(C)(C)C)=O)=C2)C(N)=O
Molecular Formula
C33H33F3N6O4S
Molecular Weight
666.71
References & Citations
[1]Wang H, et al. Design, synthesis, and structure activity relationship (SAR) studies of novel imidazo[1,2-a] pyridine derivatives as Nek2 inhibitors. Bioorg Med Chem. 2020 Dec 1;28 (23) :115775.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
NEK2

Chemical Information

Nek2-IN-6
CAS Number2410376-96-2
PubChem CID164886627
IUPAC Nametert-butyl 3-[[4-[3-[5-carbamoyl-4-[1-[2-(trifluoromethyl)phenyl]ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]pyrazol-1-yl]methyl]azetidine-1-carboxylate
Molecular FormulaC33H33F3N6O4S
Molecular Weight666.7
XLogP5.9
Topological Polar Surface Area145
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count10
Heavy Atom Count47
Formal Charge0
Complexity1120
SMILES
CC(C1=CC=CC=C1C(F)(F)F)OC2=C(SC(=C2)C3=CN=C4N3C=CC(=C4)C5=CN(N=C5)CC6CN(C6)C(=O)OC(C)(C)C)C(=O)N
InChI
InChI=1S/C33H33F3N6O4S/c1-19(23-7-5-6-8-24(23)33(34,35)36)45-26-12-27(47-29(26)30(37)43)25-14-38-28-11-21(9-10-42(25)28)22-13-39-41(18-22)17-20-15-40(16-20)31(44)46-32(2,3)4/h5-14,18-20H,15-17H2,1-4H3,(H2,37,43)
InChIKey
BIBPJUJXXFJYPF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Nek2-IN-6
CAS: 2410376-96-2
CID: 164886627
Formula: C33H33F3N6O4S
MW: 666.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight666.7
XLogP35.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count10
Exact Mass666.22360921
Monoisotopic Mass666.22360921
Topological Polar Surface Area145 Ų
Heavy Atom Count47
Formal Charge0
Complexity1120
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-137046Nek2-IN-4
HY-120330Nek2-IN-5
HY-P702739-01NEK2, Human (Active)
HY-153749-01Nek2/Hec1-IN-2
HY-176463-01Nek2/Hec1-IN-3
HY-P701822NEK2, Human (T175A)
HY-136747-01Nek2/Hec1-IN-1
HY-P704023NEK2, Human (sf9, GST)
HY-P82165-01NEK2 Antibody (YA1910, Rabbit)
HY-P701823NEK2, Human (T175A, His)

Alternative Products

CatalogName
GTR19212245-01Nek2-IN-6
525901-01NEK2
486747NEK2 (Serine/Threonine-Protein Kinase Nek2)
GWB-B3CEF0NEK2 Antibody
7719-5NEK2, Active
392094NEK2 discontinued
T28141-01Nek2-IN-5

Popular Products