bis[2-(4-fluorophenyl)phenyl]methanone

C25H16F2O — CID 141033453

IUPACbis[2-(4-fluorophenyl)phenyl]methanone
SMILESO=C(c1ccccc1-c1ccc(F)cc1)c1ccccc1-c1ccc(F)cc1
InChIInChI=1S/C25H16F2O/c26-19-13-9-17(10-14-19)21-5-1-3-7-23(21)25(28)24-8-4-2-6-22(24)18-11-15-20(27)16-12-18/h1-16H
InChIKeyXYCIDKLXPXTPKT-UHFFFAOYSA-N
MW370.40 g/mol
LogP6.53
Rot. Bonds4

About bis[2-(4-fluorophenyl)phenyl]methanone

bis[2-(4-fluorophenyl)phenyl]methanone (PubChem CID 141033453) has the molecular formula C25H16F2O and a molecular weight of 370.40 g/mol. Its IUPAC name is bis[2-(4-fluorophenyl)phenyl]methanone.

Molecular Properties

Compound Namebis[2-(4-fluorophenyl)phenyl]methanone
PubChem CID141033453
Molecular FormulaC25H16F2O
Molecular Weight370.40 g/mol
Exact Mass370.12
IUPAC Namebis[2-(4-fluorophenyl)phenyl]methanone
SMILESO=C(c1ccccc1-c1ccc(F)cc1)c1ccccc1-c1ccc(F)cc1
InChIInChI=1S/C25H16F2O/c26-19-13-9-17(10-14-19)21-5-1-3-7-23(21)25(28)24-8-4-2-6-22(24)18-11-15-20(27)16-12-18/h1-16H
InChIKeyXYCIDKLXPXTPKT-UHFFFAOYSA-N
XLogP6.53
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.40
LogP ≤ 56.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of bis[2-(4-fluorophenyl)phenyl]methanone?
The IUPAC name of bis[2-(4-fluorophenyl)phenyl]methanone (CID 141033453) is bis[2-(4-fluorophenyl)phenyl]methanone.
What is the SMILES notation for bis[2-(4-fluorophenyl)phenyl]methanone?
The canonical SMILES for bis[2-(4-fluorophenyl)phenyl]methanone is O=C(c1ccccc1-c1ccc(F)cc1)c1ccccc1-c1ccc(F)cc1.
What is the InChIKey of bis[2-(4-fluorophenyl)phenyl]methanone?
The InChIKey is XYCIDKLXPXTPKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H16F2O/c26-19-13-9-17(10-14-19)21-5-1-3-7-23(21)25(28)24-8-4-2-6-22(24)18-11-15-20(27)16-12-18/h1-16H.
What are the key properties of bis[2-(4-fluorophenyl)phenyl]methanone?
bis[2-(4-fluorophenyl)phenyl]methanone has a molecular weight of 370.40 g/mol, XLogP of 6.53, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis[2-(4-fluorophenyl)phenyl]methanone is sourced from PubChem (CID 141033453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).