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Chemical structure of Febrifugine (hydrochloride)

GC52072

Febrifugine (hydrochloride)

Also known as 3-[3-[(2R,3S)-3-hydroxypiperidin-2-yl]-2-oxopropyl]quinazolin-4-one;dihydrochloride

Febrifugine (hydrochloride) is a quinazolinone alkaloid found in the roots and leaves of Dichroa febrifuga, with antimalarial activity

ChemicalCAS32434-42-7MW374.3FormulaC16H19N3O3 • 2HCl
CAS number
32434-42-7
Molecular weight
374.3
Formula
C16H19N3O3 • 2HCl
Solubility
DMSO ： 8·33 mg/mL (22·26 mM; ultrasonic and warming and heat to 60°C)
InChIKey
RDUHYEILHQUTIR-AMTWEWDESA-N
Catalogue number
GC52072
Brand
GLPBIO
Computed properties PubChem CID 25112190 · TPSA 82 Ų · H-bond donors 4 · H-bond acceptors 5
TPSA
82 Ų
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
24

SMILES C1C[C@@H]([C@H](NC1)CC(=O)CN2C=NC3=CC=CC=C3C2=O)O.Cl.Cl

Computed descriptors from PubChem (CID 25112190), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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