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L-838417-[d9]

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General Information
Catalog: BLP-013901
CAS: 1213669-91-0
Molecular Formula: C19H10D9F2N7O
Molecular Weight: 408.46

Chemical Structure

Description	CTP354, also known as C-21191, is a novel deuterated subtype-selective GABA(A) modulator. CTP may be potentially useful for treatment of neuropathic pain, spasticity and anxiety disorders.
Synonyms	CTP354; CTP-354; CTP 354; C-21191; C 21191; C21191
IUPAC Name	3-(2,5-difluorophenyl)-7-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]-6-[(2-methyl-1,2,4-triazol-3-yl)methoxy]-[1,2,4]triazolo[4,3-b]pyridazine
Isomeric SMILES	[2H]C([2H])([2H])C(C1=CC2=NN=C(N2N=C1OCC3=NC=NN3C)C4=C(C=CC(=C4)F)F)(C([2H])([2H])[2H])C([2H])([2H])[2H]
Canonical SMILES	CC(C)(C)C1=CC2=NN=C(N2N=C1OCC3=NC=NN3C)C4=C(C=CC(=C4)F)F
InChI	InChI=1S/C19H19F2N7O/c1-19(2,3)13-8-15-24-25-17(12-7-11(20)5-6-14(12)21)28(15)26-18(13)29-9-16-22-10-23-27(16)4/h5-8,10H,9H2,1-4H3/i1D3,2D3,3D3
InChI Key	BQDUNOMMYOKHEP-GQALSZNTSA-N
Purity	98%
Solubility	Soluble in DMSO, not in water
Appearance	Solid powder
Shelf Life	2 years if stored properly
Storage	Store at -20°C