Tegobuvir
5-[[6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl]methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine
Molecular Identity
Tegobuvir
5-[[6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl]methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine
PubChem CID: 23649154
2D Structure
Properties
C25H14F7N5
Molecular Formula
517.40
Molecular Weight
g/mol
517.1137
Exact Mass
Da
4.7
XLogP
Drug-like (Lipinski: < 5)
56.5
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
11
H-Bond Acceptors
765
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC=C(C(=C1)C2=NC3=CN(C=CC3=N2)CC4=NN=C(C=C4)C5=C(C=C(C=C5)C(F)(F)F)C(F)(F)F)FIsomeric SMILES
SMILES: C1=CC=C(C(=C1)C2=NC3=CN(C=CC3=N2)CC4=NN=C(C=C4)C5=C(C=C(C=C5)C(F)(F)F)C(F)(F)F)FSynonyms(20)
Tegobuvir1000787-75-65-((6-(2,4-bis(Trifluoromethyl)phenyl)pyridazin-3-yl)methyl)-2-(2-fluorophenyl)-5H-imidazo[4,5-c]pyridineGS-9190GS-3331265-[[6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl]methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine5NOK5X389MDTXSID801429175-({6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl}methyl)-2-(2-fluorophenyl)-5h-imidazo[4,5-c]pyridinetegobuvirum5-((6-(2,4-BIS(TRIFLUOROMETHYL)PHENYL)PYRIDAZIN-3-YL)METHYL)-2-(2-FLUOROPHENYL)-5H-IMIDAZO(4,5-C)PYRIDINE5-((6-(2,4-bis(trifluoromethyl)phenyl)pyridazin-3-yl)methyl)-2-(2-fluorophenyl)imidazo(4,5-c)pyridineRefChem:932660DTXCID8065408MFCD18251457
Data from PubChem (NCBI)
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