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Chemical structure of Sonidegib

GC13655

Sonidegib

Also listed as LDE225 (NVP-LDE225,Erismodegib)

LDE225 (NVP-LDE225,Erismodegib) (Erismodegib) is a potent and selective Smo antagonist with IC50 of 1·3 nM and 2·5 nM for mouse and human Smo in binding assay, respectively

ChemicalCAS956697-53-3MW485.5FormulaC26H26F3N3O3
CAS number
956697-53-3
Molecular weight
485.5
Formula
C26H26F3N3O3
Solubility
≥ 24·3mg/mL in DMSO
InChIKey
VZZJRYRQSPEMTK-CALCHBBNSA-N
Catalogue number
GC13655
Brand
GLPBIO
Computed properties PubChem CID 24775005 · XLogP 5.8 · TPSA 63.7 Ų · H-bond donors 1
XLogP
5.8
TPSA
63.7 Ų
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
5
Heavy atoms
35

SMILES C[C@@H]1CN(C[C@@H](O1)C)C2=NC=C(C=C2)NC(=O)C3=CC=CC(=C3C)C4=CC=C(C=C4)OC(F)(F)F

Computed descriptors from PubChem (CID 24775005), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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