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Chemical structure of Candesartan Cilexetil

GC12318

Candesartan Cilexetil

Also known as 1-cyclohexyloxycarbonyloxyethyl 2-ethoxy-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]benzimidazole-4-carboxylate

Prodrug of the angiotensin II receptor 1 (AT1) antagonist candesartan

ChemicalCAS145040-37-5MW610.66FormulaC33H34N6O6
CAS number
145040-37-5
Molecular weight
610.66
Formula
C33H34N6O6
Solubility
≥ 24mg/mL in DMSO
InChIKey
GHOSNRCGJFBJIB-UHFFFAOYSA-N
Catalogue number
GC12318
Brand
GLPBIO
Computed properties PubChem CID 2540 · XLogP 7 · TPSA 143 Ų · H-bond donors 1
XLogP
7
TPSA
143 Ų
H-bond donors
1
H-bond acceptors
10
Rotatable bonds
13
Heavy atoms
45

SMILES CCOC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5)C(=O)OC(C)OC(=O)OC6CCCCC6

Computed descriptors from PubChem (CID 2540), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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