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Chemical structure of Itacitinib

GC19204

Itacitinib

Also known as 2-[1-[1-[3-fluoro-2-(trifluoromethyl)pyridine-4-carbonyl]piperidin-4-yl]-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]azetidin-3-yl]acetonitrile

Itacitinib is a potent and selective inhibitor of JAK1, with >20-fold selectivity for JAK1 over JAK2 and >100-fold over JAK3 and TYK2; Itacitinib is used in the research of myelofibrosis

ChemicalCAS1334298-90-6MW553.51FormulaC26H23F4N9O
CAS number
1334298-90-6
Molecular weight
553.51
Formula
C26H23F4N9O
Solubility
DMSO ： ≥ 30 mg/mL (54·20 mM)
InChIKey
KTBSXLIQKWEBRB-UHFFFAOYSA-N
Catalogue number
GC19204
Brand
GLPBIO
Computed properties PubChem CID 53380437 · XLogP 1.6 · TPSA 120 Ų · H-bond donors 1
XLogP
1.6
TPSA
120 Ų
H-bond donors
1
H-bond acceptors
11
Rotatable bonds
5
Heavy atoms
40

SMILES C1CN(CCC1N2CC(C2)(CC#N)N3C=C(C=N3)C4=C5C=CNC5=NC=N4)C(=O)C6=C(C(=NC=C6)C(F)(F)F)F

Computed descriptors from PubChem (CID 53380437), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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Universities, hospitals and biotech companies across Israel. Research use only — not for diagnostic or therapeutic use.