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Candesartan Celexetil Ester

CAT: 0024-sc-204666ASize: 250 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-204666ASize:250 mg
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CAS Number
145040-37-5

Chemical Information

Candesartan Cilexetil

Candesartan cilexetil is a member of biphenyls.

CAS Number145040-37-5
PubChem CID2540
IUPAC Name1-cyclohexyloxycarbonyloxyethyl 2-ethoxy-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]benzimidazole-4-carboxylate
Molecular FormulaC33H34N6O6
Molecular Weight610.7
XLogP7
Topological Polar Surface Area143
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count13
Heavy Atom Count45
Formal Charge0
Complexity962
SMILES
CCOC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5)C(=O)OC(C)OC(=O)OC6CCCCC6
InChI
InChI=1S/C33H34N6O6/c1-3-42-32-34-28-15-9-14-27(31(40)43-21(2)44-33(41)45-24-10-5-4-6-11-24)29(28)39(32)20-22-16-18-23(19-17-22)25-12-7-8-13-26(25)30-35-37-38-36-30/h7-9,12-19,21,24H,3-6,10-11,20H2,1-2H3,(H,35,36,37,38)
InChIKey
GHOSNRCGJFBJIB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Candesartan Cilexetil
CAS: 145040-37-5
CID: 2540
Formula: C33H34N6O6
MW: 610.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight610.7
XLogP37
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count13
Exact Mass610.25398283
Monoisotopic Mass610.25398283
Topological Polar Surface Area143 Ų
Heavy Atom Count45
Formal Charge0
Complexity962
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
sc-504605Candesartan Methyl Ester
sc-211008Candesartan Ethyl Ester
sc-217826Candesartan Methyl Ester-d5
sc-219263N-Trityl Candesartan Trityl Ester
sc-212300N-Trityl Candesartan Ethyl Ester
sc-219262N-Trityl Candesartan Methyl Ester-d5
sc-475746N-Trityl Candesartan Methyl Ester-d4
sc-219261N-Trityl Candesartan Methyl Ester Methoxy Analogue
sc-217825Candesartan
sc-217825ACandesartan

Alternative Products

CatalogName
267856-01Candesartan methyl ester
MBS6071958-01Candesartan Ethyl Ester
005555Candesartan-d4 Methyl Ester
005548Candesartan tert-Butyl Ester
HY-W098792RCandesartan methyl ester (Standard)
RM-C192019-01Candesartan Ethyl Ester Desethyl Analog
RFC05445-01N-Cilexetil candesartan ethyl ester
290475-01N-Trityl candesartan ethyl ester
TRC-D282050-100MGO-Desetheyl Candesartan Methyl Ester
RM-C192018-01Candesartan Methyl Ester Desethyl Analog

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