Obefazimod
8-chloro-N-[4-(trifluoromethoxy)phenyl]quinolin-2-amine
Molecular Identity
Obefazimod
8-chloro-N-[4-(trifluoromethoxy)phenyl]quinolin-2-amine
PubChem CID: 49846599
2D Structure
Properties
C16H10ClF3N2O
Molecular Formula
338.71
Molecular Weight
g/mol
338.0434
Exact Mass
Da
5.9
XLogP
Above Lipinski threshold
34.2
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
6
H-Bond Acceptors
388
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC2=C(C(=C1)Cl)N=C(C=C2)NC3=CC=C(C=C3)OC(F)(F)FIsomeric SMILES
SMILES: C1=CC2=C(C(=C1)Cl)N=C(C=C2)NC3=CC=C(C=C3)OC(F)(F)FSynonyms(20)
1258453-75-6obefazimodABX464ABX-4648-chloro-N-[4-(trifluoromethoxy)phenyl]quinolin-2-amine8-Chloro-N-(4-(trifluoromethoxy)phenyl)quinolin-2-amineSPL-46426RU378B9VAbx 4642-Quinolinamine, 8-chloro-N-(4-(trifluoromethoxy)phenyl)-RefChem:167336Rev Inhibitor ABX-464CBC 80/20 Binder ABX-464Cap Binding Complex 80/20 Binder ABX-464824-937-7
Data from PubChem (NCBI)
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