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Chemical structure of Itacnosertib

GC63416

Itacnosertib

Also known as 2-N-[3-methoxy-4-(4-methylpiperazin-1-yl)phenyl]-4-N-(2-pyridin-2-yl-3-pyridinyl)pyrimidine-2,4-diamine

Itacnosertib (TP-0184) is both inhibitor to JAK2, ACVR1 (ALK2) and ALK5 as described in WO2014151871

ChemicalCAS1628870-27-8MW468.55FormulaC26H28N8O
CAS number
1628870-27-8
Molecular weight
468.55
Formula
C26H28N8O
Solubility
DMSO ： 12·5 mg/mL (26·68 mM; ultrasonic and warming and heat to 60°C)
InChIKey
XSQKEVGTZSBVBR-UHFFFAOYSA-N
Catalogue number
GC63416
Brand
GLPBIO
Computed properties PubChem CID 86290265 · XLogP 3.4 · TPSA 91.3 Ų · H-bond donors 2
XLogP
3.4
TPSA
91.3 Ų
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
7
Heavy atoms
35

SMILES CN1CCN(CC1)C2=C(C=C(C=C2)NC3=NC=CC(=N3)NC4=C(N=CC=C4)C5=CC=CC=N5)OC

Computed descriptors from PubChem (CID 86290265), 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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