Seladelpar
2-[4-[(2R)-2-ethoxy-3-[4-(trifluoromethyl)phenoxy]propyl]sulfanyl-2-methylphenoxy]acetic acid
Molecular Identity
Seladelpar
2-[4-[(2R)-2-ethoxy-3-[4-(trifluoromethyl)phenoxy]propyl]sulfanyl-2-methylphenoxy]acetic acid
PubChem CID: 11236126
2D Structure
Properties
C21H23F3O5S
Molecular Formula
444.50
Molecular Weight
g/mol
444.1218
Exact Mass
Da
5.2
XLogP
Above Lipinski threshold
90.3
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
9
H-Bond Acceptors
511
Complexity
SMILES
Canonical SMILES
SMILES: CCOC(COC1=CC=C(C=C1)C(F)(F)F)CSC2=CC(=C(C=C2)OCC(=O)O)CIsomeric SMILES
SMILES: CCO[C@H](COC1=CC=C(C=C1)C(F)(F)F)CSC2=CC(=C(C=C2)OCC(=O)O)CSynonyms(20)
Seladelpar851528-79-5RWJ-800025(+)-MBX-80257C00L34NB92-[4-[(2R)-2-ethoxy-3-[4-(trifluoromethyl)phenoxy]propyl]sulfanyl-2-methylphenoxy]acetic acidDTXSID001045332((4-(((2R)-2-Ethoxy-3-(4-(trifluoromethyl)phenoxy)propyl)thio)-2-methylphenyl)oxy)acetic acid2-[4-[[(2R)-2-Ethoxy-3-[4-(trifluoromethyl)phenoxy]propyl]thio]-2-methylphenoxy]acetic acidAcetic acid, (4-(((2R)-2-ethoxy-3-(4-(trifluoromethyl)phenoxy)propyl)thio)-2-methylphenoxy)-Acetic acid, 2-(4-(((2R)-2-ethoxy-3-(4-(trifluoromethyl)phenoxy)propyl)thio)-2-methylphenoxy)-seladelparum2-(4-(((2R)-2-Ethoxy-3-(4-(trifluoromethyl)phenoxy)propyl)thio)-2-methylphenoxy)acetic acid2-(4-((2R)-2-ethoxy-3-(4-(trifluoromethyl)phenoxy)propyl)sulfanyl-2-methylphenoxy)acetic acidRefChem:931578
Data from PubChem (NCBI)
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