UNII-SS2LQQ8094
4-[1-[[6-[[4-(trifluoromethyl)phenyl]methyl]-6-azaspiro[2.5]octane-7-carbonyl]amino]cyclopropyl]benzoic acid
Molecular Identity
UNII-SS2LQQ8094
4-[1-[[6-[[4-(trifluoromethyl)phenyl]methyl]-6-azaspiro[2.5]octane-7-carbonyl]amino]cyclopropyl]benzoic acid
PubChem CID: 71186236
2D Structure
Properties
C26H27F3N2O3
Molecular Formula
472.50
Molecular Weight
g/mol
472.1974
Exact Mass
Da
2.6
XLogP
Drug-like (Lipinski: < 5)
69.6
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
7
H-Bond Acceptors
777
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
UNII-SS2LQQ8094CR6086CR-6086Benzoic acid, 4-(1-(((6-((4-(trifluoromethyl)phenyl)methyl)-6-azaspiro(2.5)oct-5-yl)carbonyl)amino)cyclopropyl)-Benzoic acid, 4-[1-[[[6-[[4-(trifluoromethyl)phenyl]methyl]-6-azaspiro[2.5]oct-5-yl]carbonyl]amino]cyclopropyl]-RefChem:128367EP4 Antagonist CR6086EP4 Receptor Antagonist CR6086PGE2 Receptor Antagonist CR6086Prostaglandin E2 Receptor Antagonist CR60864-(1-((5R)-6-((4-(trifluoromethyl)phenyl)methyl)-6-azaspiro(2.5)octane-5-amido)cyclopropyl)benzoic acid4-{1-[(5R)-6-{[4-(trifluoromethyl)phenyl]methyl}-6-azaspiro[2.5]octane-5-amido]cyclopropyl}benzoic acidVorbipiprant1417742-86-9Vorbipiprant, (+/-)-
Data from PubChem (NCBI)
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