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LNK01004

CAT: 0013-GTR19249392-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19249392-02Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
LNK01004 is a potent, multi-targeted JAK inhibitor with IC50 values of 10 nM, <0.51 nM, and 1.0 nM for JAK1, JAK2, and TYK2, respectively. It effectively blocks cytokine-induced STAT phosphorylation and is a valuable research tool for studying inflammatory skin conditions like atopic dermatitis in both cellular and animal models.
CAS Number
2445500-24-1
Field of Research
Cardiovascular Research, Epigenetics & Chromatin, Signal Transduction, Stem Cell & Developmental Biology
Smiles
N#CCNC (=O) C=1C=CC (=CC1) C2=NC (=NC=C2C) NC=3C=NN (C3) C4CC (OC (C) (C) C4) (C) C
Molecular Formula
C26H31N7O2
Molecular Weight
473.57
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-(cyanomethyl)-4-[5-methyl-2-[[1-(2,2,6,6-tetramethyloxan-4-yl)pyrazol-4-yl]amino]pyrimidin-4-yl]benzamide
CAS Number2445500-24-1
PubChem CID154928007
IUPAC NameN-(cyanomethyl)-4-[5-methyl-2-[[1-(2,2,6,6-tetramethyloxan-4-yl)pyrazol-4-yl]amino]pyrimidin-4-yl]benzamide
Molecular FormulaC26H31N7O2
Molecular Weight473.6
XLogP3
Topological Polar Surface Area118
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count35
Formal Charge0
Complexity770
SMILES
CC1=CN=C(N=C1C2=CC=C(C=C2)C(=O)NCC#N)NC3=CN(N=C3)C4CC(OC(C4)(C)C)(C)C
InChI
InChI=1S/C26H31N7O2/c1-17-14-29-24(32-22(17)18-6-8-19(9-7-18)23(34)28-11-10-27)31-20-15-30-33(16-20)21-12-25(2,3)35-26(4,5)13-21/h6-9,14-16,21H,11-13H2,1-5H3,(H,28,34)(H,29,31,32)
InChIKey
FKUOLCVQIHONCW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(cyanomethyl)-4-[5-methyl-2-[[1-(2,2,6,6-tetramethyloxan-4-yl)pyrazol-4-yl]amino]pyrimidin-4-yl]benzamide
CAS: 2445500-24-1
CID: 154928007
Formula: C26H31N7O2
MW: 473.6
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight473.6
XLogP33
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass473.25392326
Monoisotopic Mass473.25392326
Topological Polar Surface Area118 Ų
Heavy Atom Count35
Formal Charge0
Complexity770
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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CatalogName
T205387-01LNK01004

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