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N-Desmethyl Azelastine-[d4]

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General Information
Catalog: BLP-004954
Molecular Formula: C21H18D4ClN3OD4
Molecular Weight: 371.90

Chemical Structure

Description	N-desmethyl Azelastine-[d4] is the labelled analogue of N-Desmethyl Azelastine, which is the main phase I metabolite of Azelastine.
Synonyms	N-desmethyl Azelastine D4; 4-[(4-Chlorophenyl)methyl]-2-(hexahydro-1H-azepin-4-yl)-1(2H)-phthalazinone-d4; Demethylazelastine-d4
IUPAC Name	2-(azepan-4-yl)-4-[(4-chlorophenyl)methyl]-5,6,7,8-tetradeuteriophthalazin-1-one
Related CAS	47491-38-3 (unlabelled)
Canonical SMILES	C1CC(CCNC1)N2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=C(C=C4)Cl
InChI	InChI=1S/C21H22ClN3O/c22-16-9-7-15(8-10-16)14-20-18-5-1-2-6-19(18)21(26)25(24-20)17-4-3-12-23-13-11-17/h1-2,5-10,17,23H,3-4,11-14H2/i1D,2D,5D,6D
InChI Key	WRYCMIFVXDQIKN-NMRLXUNGSA-N
Appearance	Pale Yellow Solid
Storage	Store at 2-8°C