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Chemical structure of Quinapril HCl

GC12368

Quinapril HCl

Also known as (3S)-2-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid;hydrochloride

Quinapril (hydrochloride) (CI-906) is a prodrug that belongs to the angiotensin-converting enzyme (ACE) inhibitor class of medications

ChemicalCAS82586-55-8MW474.98FormulaC25H30N2O5·HCl
CAS number
82586-55-8
Molecular weight
474.98
Formula
C25H30N2O5·HCl
Solubility
≥ 19·6mg/mL in DMSO
InChIKey
IBBLRJGOOANPTQ-JKVLGAQCSA-N
Catalogue number
GC12368
Brand
GLPBIO
Computed properties PubChem CID 54891 · TPSA 95.9 Ų · H-bond donors 3 · H-bond acceptors 6
TPSA
95.9 Ų
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
33

SMILES CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2CC3=CC=CC=C3C[C@H]2C(=O)O.Cl

Computed descriptors from PubChem (CID 54891), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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