1165910-22-4
4-[(2R)-2-[(1R)-2,2,2-trifluoro-1-hydroxyethyl]pyrrolidin-1-yl]-2-(trifluoromethyl)benzonitrile
Molecular Identity
1165910-22-4
4-[(2R)-2-[(1R)-2,2,2-trifluoro-1-hydroxyethyl]pyrrolidin-1-yl]-2-(trifluoromethyl)benzonitrile
PubChem CID: 44137686
2D Structure
Properties
C14H12F6N2O
Molecular Formula
338.25
Molecular Weight
g/mol
338.0854
Exact Mass
Da
3.7
XLogP
Drug-like (Lipinski: < 5)
47.3
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
9
H-Bond Acceptors
468
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
1165910-22-4LGD-4033LigandrolVK-52111EJT54415A4-[(2R)-2-[(1R)-2,2,2-TRIFLUORO-1-HYDROXYETHYL]PYRROLIDIN-1-YL]-2-(TRIFLUOROMETHYL)BENZONITRILEVk5211LIGANDROL [NFLIS-DRUG]4-[(2R)-2-[(1R)-2,2,2-trifluoro-1-hydroxyethyl]-1-pyrrolidinyl]-2-(trifluoromethyl)benzonitrileBenzonitrile, 4-[(2R)-2-[(1R)-2,2,2-trifluoro-1-hydroxyethyl]-1-pyrrolidinyl]-2-(trifluoromethyl)-LIGANDROL (NFLIS-DRUG)4-((2R)-2-((1R)-2,2,2-TRIFLUORO-1-HYDROXYETHYL)-1-PYRROLIDINYL)-2-(TRIFLUOROMETHYL)BENZONITRILEBENZONITRILE, 4-((2R)-2-((1R)-2,2,2-TRIFLUORO-1-HYDROXYETHYL)-1-PYRROLIDINYL)-2-(TRIFLUOROMETHYL)-4-((2R)-2-((1R)-2,2,2-Trifluoro-1-hydroxyethyl)pyrrolidin-1-yl)-2-(trifluoromethyl)benZonitrile4-{(2R)-2-[(1R)-2,2,2-Trifluoro-1-hydroxyethyl]-1-pyrrolidinyl}-2-(trifluoromethyl)benzonitrile
Data from PubChem (NCBI)
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