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Azilsartan Methyl Ester

CAT: 1596-AR-A03173-02Size: 150Dry Ice: NoHazardous: No
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CAS Number
147403-52-9
Synonyms
1- [[2'- (2, 5- dihydro- 5- oxo- 1, 2, 4- oxadiazol- 3- yl) [1, 1'- biphenyl] - 4- yl] methyl] - 2- ethoxy-1H- Benzimidazole- 7- carboxylic acid methyl ester
Molecular Formula
C26H22N4O5
Molecular Weight
470.49
API Name
Azilsartan

Chemical Information

Methyl 2-ethoxy-1-((2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)-biphenyl-4-yl)methyl)-1H-benz-imidazole-7-carboxylate
CAS Number147403-52-9
PubChem CID135723831
IUPAC Namemethyl 2-ethoxy-3-[[4-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]phenyl]methyl]benzimidazole-4-carboxylate
Molecular FormulaC26H22N4O5
Molecular Weight470.5
XLogP4.7
Topological Polar Surface Area104
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Heavy Atom Count35
Formal Charge0
Complexity799
SMILES
CCOC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NOC(=O)N5)C(=O)OC
InChI
InChI=1S/C26H22N4O5/c1-3-34-25-27-21-10-6-9-20(24(31)33-2)22(21)30(25)15-16-11-13-17(14-12-16)18-7-4-5-8-19(18)23-28-26(32)35-29-23/h4-14H,3,15H2,1-2H3,(H,28,29,32)
InChIKey
PCMXVTVLQVGYLX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl 2-ethoxy-1-((2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)-biphenyl-4-yl)methyl)-1H-benz-imidazole-7-carboxylate
CAS: 147403-52-9
CID: 135723831
Formula: C26H22N4O5
MW: 470.5
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight470.5
XLogP34.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Exact Mass470.15901982
Monoisotopic Mass470.15901982
Topological Polar Surface Area104 Ų
Heavy Atom Count35
Formal Charge0
Complexity799
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