5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole

C21H16F2N2 — CID 44573407

IUPAC5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole
SMILESFc1ccc(C2(c3ccc(F)cc3)CN=C(c3ccccc3)N2)cc1
InChIInChI=1S/C21H16F2N2/c22-18-10-6-16(7-11-18)21(17-8-12-19(23)13-9-17)14-24-20(25-21)15-4-2-1-3-5-15/h1-13H,14H2,(H,24,25)
InChIKeyQHLIBNPMZZLGDJ-UHFFFAOYSA-N
MW334.37 g/mol
LogP4.26
Rot. Bonds3

About 5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole

5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole (PubChem CID 44573407) has the molecular formula C21H16F2N2 and a molecular weight of 334.37 g/mol. Its IUPAC name is 5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole.

Molecular Properties

Compound Name5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole
PubChem CID44573407
Molecular FormulaC21H16F2N2
Molecular Weight334.37 g/mol
Exact Mass334.13
IUPAC Name5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole
SMILESFc1ccc(C2(c3ccc(F)cc3)CN=C(c3ccccc3)N2)cc1
InChIInChI=1S/C21H16F2N2/c22-18-10-6-16(7-11-18)21(17-8-12-19(23)13-9-17)14-24-20(25-21)15-4-2-1-3-5-15/h1-13H,14H2,(H,24,25)
InChIKeyQHLIBNPMZZLGDJ-UHFFFAOYSA-N
XLogP4.26
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.37
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole?
The IUPAC name of 5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole (CID 44573407) is 5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole.
What is the SMILES notation for 5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole?
The canonical SMILES for 5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole is Fc1ccc(C2(c3ccc(F)cc3)CN=C(c3ccccc3)N2)cc1.
What is the InChIKey of 5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole?
The InChIKey is QHLIBNPMZZLGDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16F2N2/c22-18-10-6-16(7-11-18)21(17-8-12-19(23)13-9-17)14-24-20(25-21)15-4-2-1-3-5-15/h1-13H,14H2,(H,24,25).
What are the key properties of 5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole?
5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole has a molecular weight of 334.37 g/mol, XLogP of 4.26, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-bis(4-fluorophenyl)-2-phenyl-1,4-dihydroimidazole is sourced from PubChem (CID 44573407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).