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Chemical structure of Lubeluzole dihydrochloride

GC72780

Lubeluzole dihydrochloride

Also known as (2S)-1-[4-[1,3-benzothiazol-2-yl(methyl)amino]piperidin-1-yl]-3-(3,4-difluorophenoxy)propan-2-ol;dihydrochloride

Lubeluzole (didrochloride) is a neuroprotective agent which blockades neuronal voltage-gated sodium channels

ChemicalCAS144665-09-8MW506.44FormulaC22H27Cl2F2N3O2S
CAS number
144665-09-8
Molecular weight
506.44
Formula
C22H27Cl2F2N3O2S
Solubility
H2O ： 2 mg/mL (3·95 mM; Need ultrasonic and warming)
InChIKey
MIEQEADSPFZWFV-SQKCAUCHSA-N
Catalogue number
GC72780
Brand
GLPBIO
Computed properties PubChem CID 67768868 · TPSA 77.1 Ų · H-bond donors 3 · H-bond acceptors 8
TPSA
77.1 Ų
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
32

SMILES CN(C1CCN(CC1)C[C@@H](COC2=CC(=C(C=C2)F)F)O)C3=NC4=CC=CC=C4S3.Cl.Cl

Computed descriptors from PubChem (CID 67768868), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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