Products for Research Use Only
RegisterLogin

Obefazimod

CAT: 0931-T8311-01Size: 2 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T8311-01Size:2 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1258453-75-6
Target
HIV Protease
Related Pathways
Microbiology/Virology, Proteases/Proteasome
Purity
>99.99%
Bioactivity
Obefazimod (ABX-464) is a potent anti-HIV agent. ABX464 inhibits HIV-1 replication in stimulated peripheral blood mononuclear cells (PBMCs) (IC50 : 0.1 μM - 0.5 μM)
Smiles
FC(F)(F)Oc1ccc(Nc2ccc3cccc(Cl)c3n2)cc1
Molecular Formula
C16H10ClF3N2O
Molecular Weight
338.71
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Obefazimod

ABX-464 is under investigation in clinical trial NCT03905109 (Safety Evaluation of ABX464 in Patients With Moderate to Severe Active Crohn's Disease).

CAS Number1258453-75-6
PubChem CID49846599
IUPAC Name8-chloro-N-[4-(trifluoromethoxy)phenyl]quinolin-2-amine
Molecular FormulaC16H10ClF3N2O
Molecular Weight338.71
XLogP5.9
Topological Polar Surface Area34.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count23
Formal Charge0
Complexity388
SMILES
C1=CC2=C(C(=C1)Cl)N=C(C=C2)NC3=CC=C(C=C3)OC(F)(F)F
InChI
InChI=1S/C16H10ClF3N2O/c17-13-3-1-2-10-4-9-14(22-15(10)13)21-11-5-7-12(8-6-11)23-16(18,19)20/h1-9H,(H,21,22)
InChIKey
OZOGDCZJYVSUBR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Obefazimod
CAS: 1258453-75-6
CID: 49846599
Formula: C16H10ClF3N2O
MW: 338.71
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight338.71
XLogP35.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass338.0433751
Monoisotopic Mass338.0433751
Topological Polar Surface Area34.2 Ų
Heavy Atom Count23
Formal Charge0
Complexity388
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
GTR19167129-01Obefazimod
HY-100870RObefazimod (Standard)

Popular Products