Irbesartan-d3

Base Information

• Chemical Name: Irbesartan-d3
• CAS No.: 1185120-76-6
• Molecular Formula: C25H28N6O
• Molecular Weight: 431.5
• DSSTox Substance ID: DTXSID00662041
• Wikidata: Q82579298
• Mol file: 1185120-76-6.mol

Synonyms:Irbesartan-d3;1185120-76-6;DTXSID00662041;J-003806;2-(4,4,4-~2~H_3_)Butyl-3-{[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl}-1,3-diazaspiro[4.4]non-1-en-4-one

Chemical Property of Irbesartan-d3

Chemical Property:

• Storage Temp.: -20°C Freezer
• Solubility.: Chloroform, Ethanol, Methanol
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 431.25128978
• Heavy Atom Count: 32
• Complexity: 682

Purity/Quality:

90%+ ^*data from raw suppliers

IRBESARTAN-D3 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCC1=NC2(CCCC2)C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5
• Isomeric SMILES: [2H]C([2H])([2H])CCCC1=NC2(CCCC2)C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5
• Uses: Labeled Irbesartan, an angiotensin II type 1 (AII1)-receptor antagonist