Molecular Identity
Pleconaril
3-[3,5-dimethyl-4-[3-(3-methyl-1,2-oxazol-5-yl)propoxy]phenyl]-5-(trifluoromethyl)-1,2,4-oxadiazole
PubChem CID: 1684
2D Structure
Properties
C18H18F3N3O3
Molecular Formula
381.30
Molecular Weight
g/mol
381.1300
Exact Mass
Da
4.6
XLogP
Drug-like (Lipinski: < 5)
74.2
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
9
H-Bond Acceptors
471
Complexity
SMILES
Canonical SMILES
SMILES: CC1=CC(=CC(=C1OCCCC2=CC(=NO2)C)C)C3=NOC(=N3)C(F)(F)FIsomeric SMILES
SMILES: CC1=CC(=CC(=C1OCCCC2=CC(=NO2)C)C)C3=NOC(=N3)C(F)(F)FSynonyms(20)
Pleconaril153168-05-9PicovirWin-63843VP-63843Win 63843WIN63843PleconariloDTXSID8057649VP 63843VP638433-[3,5-dimethyl-4-[3-(3-methyl-1,2-oxazol-5-yl)propoxy]phenyl]-5-(trifluoromethyl)-1,2,4-oxadiazole9H4570Q89D3-[3,5-Dimethyl-4-[3-(3-methyl-5-isoxazolyl)propoxy]phenyl]-5-(trifluoromethyl)-1,2,4-oxadiazoleDTXCID9031438
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Pleconaril
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