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Chemical structure of Halofuginone (RU-19110)

GC31650

Halofuginone (RU-19110)

Also known as 7-bromo-6-chloro-3-[3-(3-hydroxypiperidin-2-yl)-2-oxopropyl]quinazolin-4-one

Halofuginone (RU-19110) (RU-19110), a Febrifugine derivative, is a competitive prolyl-tRNA synthetase inhibitor with a Ki of 18·3 nM

ChemicalCAS55837-20-2MW414.68FormulaC16H17BrClN3O3
CAS number
55837-20-2
Molecular weight
414.68
Formula
C16H17BrClN3O3
Solubility
DMSO ： 9 mg/mL (21·70 mM)
InChIKey
LVASCWIMLIKXLA-UHFFFAOYSA-N
Catalogue number
GC31650
Brand
GLPBIO
Computed properties PubChem CID 62894 · XLogP 1.4 · TPSA 82 Ų · H-bond donors 2
XLogP
1.4
TPSA
82 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
24

SMILES C1CC(C(NC1)CC(=O)CN2C=NC3=CC(=C(C=C3C2=O)Cl)Br)O

Computed descriptors from PubChem (CID 62894), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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