Ro 48-8071, 2,3-oxidosqualene cyclase (OSC) inhibitor

Key facts

CAS number

161582-11-2

Purity

>98%

Molecular weight

448.4 Da

Molecular formula

C₂₃H₂₇BrFNO₂

PubChem

1949

Nature

Synthetic

Solubility

Soluble in water to 25 mM

Biochemical name

[4-({6-[Allyl(methyl)amino]hexyl}oxy)-2-fluorophenyl](4-bromophenyl)methanone

Biological description

Potent 2,3-oxidosqualene cyclase (OSC) inhibitor (IC₅₀ = 6.5 nM). Displays lipid lowering activity. Active in vivo.

Canonical smiles

CN(CCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=C(C=C2)Br)F)CC=C

InChi

InChI=1S/C23H27BrFNO2/c1-3-14-26(2)15-6-4-5-7-16-28-20-12-13-21(22(25)17-20)23(27)18-8-10-19(24)11-9-18/h3,8-13,17H,1,4-7,14-16H2,2H3

InChiKey

CMYCCJYVZIMDFU-UHFFFAOYSA-N

IUPAC Name

(4-bromophenyl)-[2-fluoro-4-[6-[methyl(prop-2-enyl)amino]hexoxy]phenyl]methanone