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Candesartan

CAT: 0013-GTR19175130-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19175130-01Size:50 mg
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Description
Candesartan
CAS Number
139481-59-7
Product Name Alternative
CV-11974
Field of Research
Neuroscience
Purity
>98%
Bioactivity
Angiotensin AT1 receptor antagonist
Form
Powder
Solubility
Soluble in DMSO (up to 40 mg/ml)
Smiles
CCOc1nc2cccc (C (=O) O) c2n1Cc1ccc (cc1) c1ccccc1c1n[nH]nn1
Molecular Formula
C24H20N6O3
Molecular Weight
400.45
Storage Conditions
-20°C
Notes
For research use only.
Other Product Names
2-Ethoxy-1-[[2’- (1H-tetrazol-5-yl) [1,1’-biphenyl]-4-yl]methyl]-1H-benzimidazole-7-carboxylic acid

Chemical Information

Candesartan

Candesartan is a benzimidazolecarboxylic acid that is 1H-benzimidazole-7-carboxylic acid substituted by an ethoxy group at position 2 and a ({2'-(1H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl}methyl) group at position 1. It is a angiotensin receptor antagonist used for the treatment of hypertension. It has a role as an antihypertensive agent, a xenobiotic, an angiotensin receptor antagonist and an environmental contaminant. It is a benzimidazolecarboxylic acid and a biphenylyltetrazole. It is a conjugate acid of a candesartan(2-).

CAS Number139481-59-7
PubChem CID2541
IUPAC Name2-ethoxy-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]benzimidazole-4-carboxylic acid
Molecular FormulaC24H20N6O3
Molecular Weight440.5
XLogP4.1
Topological Polar Surface Area119
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count33
Formal Charge0
Complexity660
SMILES
CCOC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5)C(=O)O
InChI
InChI=1S/C24H20N6O3/c1-2-33-24-25-20-9-5-8-19(23(31)32)21(20)30(24)14-15-10-12-16(13-11-15)17-6-3-4-7-18(17)22-26-28-29-27-22/h3-13H,2,14H2,1H3,(H,31,32)(H,26,27,28,29)
InChIKey
HTQMVQVXFRQIKW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Candesartan
CAS: 139481-59-7
CID: 2541
Formula: C24H20N6O3
MW: 440.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight440.5
XLogP34.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass440.15968852
Monoisotopic Mass440.15968852
Topological Polar Surface Area119 Ų
Heavy Atom Count33
Formal Charge0
Complexity660
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
A5932-5Candesartan

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