1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone

C23H18F2N2O — CID 44573531

IUPAC1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone
SMILESCC(=O)c1cccc(C2=NCC(c3ccc(F)cc3)(c3ccc(F)cc3)N2)c1
InChIInChI=1S/C23H18F2N2O/c1-15(28)16-3-2-4-17(13-16)22-26-14-23(27-22,18-5-9-20(24)10-6-18)19-7-11-21(25)12-8-19/h2-13H,14H2,1H3,(H,26,27)
InChIKeyZWLQIWVDNODMEB-UHFFFAOYSA-N
MW376.41 g/mol
LogP4.46
Rot. Bonds4

About 1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone

1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone (PubChem CID 44573531) has the molecular formula C23H18F2N2O and a molecular weight of 376.41 g/mol. Its IUPAC name is 1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone.

Molecular Properties

Compound Name1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone
PubChem CID44573531
Molecular FormulaC23H18F2N2O
Molecular Weight376.41 g/mol
Exact Mass376.14
IUPAC Name1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone
SMILESCC(=O)c1cccc(C2=NCC(c3ccc(F)cc3)(c3ccc(F)cc3)N2)c1
InChIInChI=1S/C23H18F2N2O/c1-15(28)16-3-2-4-17(13-16)22-26-14-23(27-22,18-5-9-20(24)10-6-18)19-7-11-21(25)12-8-19/h2-13H,14H2,1H3,(H,26,27)
InChIKeyZWLQIWVDNODMEB-UHFFFAOYSA-N
XLogP4.46
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.41
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone?
The IUPAC name of 1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone (CID 44573531) is 1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone.
What is the SMILES notation for 1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone?
The canonical SMILES for 1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone is CC(=O)c1cccc(C2=NCC(c3ccc(F)cc3)(c3ccc(F)cc3)N2)c1.
What is the InChIKey of 1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone?
The InChIKey is ZWLQIWVDNODMEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18F2N2O/c1-15(28)16-3-2-4-17(13-16)22-26-14-23(27-22,18-5-9-20(24)10-6-18)19-7-11-21(25)12-8-19/h2-13H,14H2,1H3,(H,26,27).
What are the key properties of 1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone?
1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone has a molecular weight of 376.41 g/mol, XLogP of 4.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]phenyl]ethanone is sourced from PubChem (CID 44573531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).