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Azilsartan Amidoxime

CAT: 1596-AR-A04722-01Size: 100 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-A04722-01Size:100 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1449029-77-9
Synonyms
(5-Methyl-2-oxo-1,3-dioxol-4-yl) methyl 2-ethoxy-1-[[2′- (N′-hydroxycarbamimidoyl) biphenyl-4-yl]methyl]-1H-benzimidazole-7-carboxylate
Molecular Formula
C29H26N4O7
Molecular Weight
542.55
API Name
Azilsartan

Chemical Information

Azilsartan Amidoxime
CAS Number1449029-77-9
PubChem CID78144897
IUPAC Name(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 2-ethoxy-3-[[4-[2-(N'-hydroxycarbamimidoyl)phenyl]phenyl]methyl]benzimidazole-4-carboxylate
Molecular FormulaC29H26N4O7
Molecular Weight542.5
XLogP4.6
Topological Polar Surface Area147
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count10
Heavy Atom Count40
Formal Charge0
Complexity979
SMILES
CCOC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=NO)N)C(=O)OCC5=C(OC(=O)O5)C
InChI
InChI=1S/C29H26N4O7/c1-3-37-28-31-23-10-6-9-22(27(34)38-16-24-17(2)39-29(35)40-24)25(23)33(28)15-18-11-13-19(14-12-18)20-7-4-5-8-21(20)26(30)32-36/h4-14,36H,3,15-16H2,1-2H3,(H2,30,32)
InChIKey
CQSKEJHMXPTBLT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Azilsartan Amidoxime
CAS: 1449029-77-9
CID: 78144897
Formula: C29H26N4O7
MW: 542.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight542.5
XLogP34.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count10
Exact Mass542.18014918
Monoisotopic Mass542.18014918
Topological Polar Surface Area147 Ų
Heavy Atom Count40
Formal Charge0
Complexity979
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

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AR-A03145-01Azilsartan
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AR-A03147-01Azilsartan-d5
AR-A03148-01Azilsartan Impurity A
AR-A03169-01Azilsartan Impurity 2
AR-A03173-01Azilsartan Methyl Ester
AR-A03153-01Azilsartan Impurity D

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