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Chemical structure of Eltanexor, (Z)-

GC19213

Eltanexor, (Z)-

Also listed as Eltanexor Z-isomer

KPT-8602 Z-isomer is the less active isomer of KPT-8602

ChemicalCAS1642300-78-4MW428.29FormulaC17H10F6N6O
CAS number
1642300-78-4
Molecular weight
428.29
Formula
C17H10F6N6O
Solubility
DMSO ： 50 mg/mL (116·74 mM);Water ： ＜ 0·1 mg/mL (insoluble)
InChIKey
JFBAVWVBLRIWHM-MLPAPPSSSA-N
Catalogue number
GC19213
Brand
GLPBIO
Computed properties PubChem CID 117763569 · XLogP 2.5 · TPSA 99.6 Ų · H-bond donors 1
XLogP
2.5
TPSA
99.6 Ų
H-bond donors
1
H-bond acceptors
11
Rotatable bonds
4
Heavy atoms
30

SMILES C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C2=NN(C=N2)/C=C(/C3=CN=CN=C3)\C(=O)N

Computed descriptors from PubChem (CID 117763569), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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