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Chemical structure of Cloperastine fendizoate

GC33851

Cloperastine fendizoate

Also known as 1-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]piperidine;2-(4-hydroxy-3-phenylbenzoyl)benzoic acid

Cloperastine fendizoate inhibits the hERG K+ currents in a concentration-dependent manner with an IC50 value of 27 nM

ChemicalCAS85187-37-7MW648.19FormulaC40H38ClNO5
CAS number
85187-37-7
Molecular weight
648.19
Formula
C40H38ClNO5
Solubility
DMSO ： ≥ 30 mg/mL (46·28 mM)
InChIKey
PXZFKAKWSHBDCP-UHFFFAOYSA-N
Catalogue number
GC33851
Brand
GLPBIO
Computed properties PubChem CID 163446 · TPSA 87.1 Ų · H-bond donors 2 · H-bond acceptors 6
TPSA
87.1 Ų
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
47

SMILES C1CCN(CC1)CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.C1=CC=C(C=C1)C2=C(C=CC(=C2)C(=O)C3=CC=CC=C3C(=O)O)O

Computed descriptors from PubChem (CID 163446), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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