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Olmesartan Acid Ethyl Ester

CAT: 0572-TRC-O550050-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-O550050-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
144689-23-6
Synonyms
4-(1-Hydroxy-1-methylethyl)-2-propyl-1-[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]-1H-imidazole-5-carboxylic Acid Ethyl Ester; Olmesartan Ethyl Ester
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
CCCc1nc(c(C(=O)OCC)n1Cc2ccc(cc2)c3ccccc3c4nnn[nH]4)C(C)(C)O
Molecular Formula
C26 H30 N6 O3
Molecular Weight
474.55
InChI
InChI=1S/C26H30N6O3/c1-5-9-21-27-23(26(3,4)34)22(25(33)35-6-2)32(21)16-17-12-14-18(15-13-17)19-10-7-8-11-20(19)24-28-30-31-29-24/h7-8,10-15,34H,5-6,9,16H2,1-4H3,(H,28,29,30,31)
Additionnal Information
IUPAC name: ethyl 5-(2-hydroxypropan-2-yl)-2-propyl-3-[[4-[2-(1H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylate
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Olmesartan Ethyl Ester
CAS Number144689-23-6
PubChem CID10600595
IUPAC Nameethyl 5-(2-hydroxypropan-2-yl)-2-propyl-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylate
Molecular FormulaC26H30N6O3
Molecular Weight474.6
XLogP3.9
Topological Polar Surface Area119
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count10
Heavy Atom Count35
Formal Charge0
Complexity686
SMILES
CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NNN=N4)C(=O)OCC)C(C)(C)O
InChI
InChI=1S/C26H30N6O3/c1-5-9-21-27-23(26(3,4)34)22(25(33)35-6-2)32(21)16-17-12-14-18(15-13-17)19-10-7-8-11-20(19)24-28-30-31-29-24/h7-8,10-15,34H,5-6,9,16H2,1-4H3,(H,28,29,30,31)
InChIKey
RYYGFMDEVYVZGY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Olmesartan Ethyl Ester
CAS: 144689-23-6
CID: 10600595
Formula: C26H30N6O3
MW: 474.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight474.6
XLogP33.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count10
Exact Mass474.23793884
Monoisotopic Mass474.23793884
Topological Polar Surface Area119 Ų
Heavy Atom Count35
Formal Charge0
Complexity686
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

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459701-01N-Trityl Ethyl Olmesartan Acid Ethyl Ester
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