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Chemical structure of Zotatifin

GC39732

Zotatifin

Also known as 4-[(2S,3R,4S,5S,6R)-4-[(dimethylamino)methyl]-2,3-dihydroxy-10,12-dimethoxy-5-phenyl-7-oxa-11-azatricyclo[6.4.0.02,6]dodeca-1(12),8,10-trien-6-yl]benzonitrile

Zotatifin (eFT226) is a potent, selective, and well-tolerated eIF4A inhibitor

ChemicalCAS2098191-53-6MW487.55FormulaC28H29N3O5
CAS number
2098191-53-6
Molecular weight
487.55
Formula
C28H29N3O5
Solubility
DMSO ： 200 mg/mL (410·21 mM; Need ultrasonic)
InChIKey
QYCXWOACFWMQFO-WZWZCULESA-N
Catalogue number
GC39732
Brand
GLPBIO
Computed properties PubChem CID 129138801 · XLogP 2.4 · TPSA 108 Ų · H-bond donors 2
XLogP
2.4
TPSA
108 Ų
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
36

SMILES CN(C)C[C@@H]1[C@H]([C@]2([C@@]([C@@H]1O)(C3=C(N=C(C=C3O2)OC)OC)O)C4=CC=C(C=C4)C#N)C5=CC=CC=C5

Computed descriptors from PubChem (CID 129138801), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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Documents
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