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Irbesartan-[d4]

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General Information
Catalog: BLP-011591
CAS: 1216883-23-6
Molecular Formula: C25H24D4N6O
Molecular Weight: 432.55

Chemical Structure

Description	Irbesartan-[d4] is the labelled analogue of Irbesartan, which is a highly potent and specific angiotensin II type 1 receptor antagonist.
Synonyms	Irbesartan D4; 2-Butyl-3-[[2'-(1H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]-1,3-diazaspiro[4.4]non-1-en-4-one-d4; BMS-186295-d4; SR-47436-d4; Aprovel-d4; Avapro-d4
IUPAC Name	2-butyl-3-[[2,3,5,6-tetradeuterio-4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1,3-diazaspiro[4.4]non-1-en-4-one
Related CAS	138402-11-6 (unlabelled)
Isomeric SMILES	[2H]C1=C(C(=C(C(=C1CN2C(=NC3(C2=O)CCCC3)CCCC)[2H])[2H])C4=CC=CC=C4C5=NNN=N5)[2H]
Canonical SMILES	CCCCC1=NC2(CCCC2)C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5
InChI	InChI=1S/C25H28N6O/c1-2-3-10-22-26-25(15-6-7-16-25)24(32)31(22)17-18-11-13-19(14-12-18)20-8-4-5-9-21(20)23-27-29-30-28-23/h4-5,8-9,11-14H,2-3,6-7,10,15-17H2,1H3,(H,27,28,29,30)/i11D,12D,13D,14D
InChI Key	YOSHYTLCDANDAN-WQKXEYJYSA-N
Melting Point	183-185°C
Purity	98%; ≥98% atom D
Solubility	Soluble in DMSO (Slightly), Methanol (Slightly, Heated)
Appearance	White Solid
Application	The isotope labeled form of Irbesartan.
Shelf Life	As supplied, 2 years from the QC date provided on the Certificate of Analysis, when stored properly
Storage	Store at 2-8°C