Bocidelpar
(3R)-3-methyl-6-[2-[[5-methyl-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenoxy]hexanoic acid
Molecular Identity
Bocidelpar
(3R)-3-methyl-6-[2-[[5-methyl-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenoxy]hexanoic acid
PubChem CID: 126752383
2D Structure
Properties
C25H27F3N2O3
Molecular Formula
460.50
Molecular Weight
g/mol
460.1974
Exact Mass
Da
5.5
XLogP
Above Lipinski threshold
64.4
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
7
H-Bond Acceptors
610
Complexity
SMILES
Canonical SMILES
SMILES: CC1=CN=C(N1CC2=CC=CC=C2OCCCC(C)CC(=O)O)C3=CC=C(C=C3)C(F)(F)FIsomeric SMILES
SMILES: CC1=CN=C(N1CC2=CC=CC=C2OCCC[C@@H](C)CC(=O)O)C3=CC=C(C=C3)C(F)(F)FSynonyms(20)
Bocidelpar2095128-20-2Bocidelpar [USAN]ASP0367FKO8A7AD54MTB-1ASP-0367BOCIDELPAR [INN]MA-0211Bocidelpar (USAN)Hexanoic acid, 3-methyl-6-(2-((5-methyl-2-(4-(trifluoromethyl)phenyl)-1H-imidazol-1-yl)methyl)phenoxy)-, (3R)-Hexanoic acid, 3-methyl-6-[2-[[5-methyl-2-[4-(trifluoromethyl)phenyl]-1H-imidazol-1-yl]methyl]phenoxy]-, (3R)-RefChem:120845UNII-FKO8A7AD54(3R)-3-methyl-6-[2-[[5-methyl-2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methyl]phenoxy]hexanoic acid
Data from PubChem (NCBI)
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