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Chemical structure of Riluzole hydrochloride

GC44841

Riluzole hydrochloride

Also listed as Riluzole (hydrochloride)

Riluzole is a benzothiazole derivative with anti-excitotoxic effects that acts by blocking the presynaptic release of glutamate, indirectly antagonizing glutamate receptors, and inactivating neuronal voltage-gated Na+ channels (ED50 = 2·3 μM)

ChemicalCAS850608-87-6MW270.7FormulaC8H5F3N2OS•HCl
CAS number
850608-87-6
Molecular weight
270.7
Formula
C8H5F3N2OS•HCl
Solubility
DMF： 30 mg/mL,DMSO： 30 mg/mL,Ethanol： 30 mg/mL,Ethanol：PBS (pH7·2)(1：20)： 0·04 mg/mL,Water： Soluble
InChIKey
QEAOELIJQRYJJS-UHFFFAOYSA-N
Catalogue number
GC44841
Brand
GLPBIO
Computed properties PubChem CID 6419992 · TPSA 76.4 Ų · H-bond donors 2 · H-bond acceptors 7
TPSA
76.4 Ų
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
1
Heavy atoms
16

SMILES C1=CC2=C(C=C1OC(F)(F)F)SC(=N2)N.Cl

Computed descriptors from PubChem (CID 6419992), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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