1,4-bis(4-benzylphenyl)benzene

C32H26 — CID 58251041

IUPAC1,4-bis(4-benzylphenyl)benzene
SMILESc1ccc(Cc2ccc(-c3ccc(-c4ccc(Cc5ccccc5)cc4)cc3)cc2)cc1
InChIInChI=1S/C32H26/c1-3-7-25(8-4-1)23-27-11-15-29(16-12-27)31-19-21-32(22-20-31)30-17-13-28(14-18-30)24-26-9-5-2-6-10-26/h1-22H,23-24H2
InChIKeyCPCIBKIIZAYMBE-UHFFFAOYSA-N
MW410.56 g/mol
LogP8.20
Rot. Bonds6

About 1,4-bis(4-benzylphenyl)benzene

1,4-bis(4-benzylphenyl)benzene (PubChem CID 58251041) has the molecular formula C32H26 and a molecular weight of 410.56 g/mol. Its IUPAC name is 1,4-bis(4-benzylphenyl)benzene.

Molecular Properties

Compound Name1,4-bis(4-benzylphenyl)benzene
PubChem CID58251041
Molecular FormulaC32H26
Molecular Weight410.56 g/mol
Exact Mass410.20
IUPAC Name1,4-bis(4-benzylphenyl)benzene
SMILESc1ccc(Cc2ccc(-c3ccc(-c4ccc(Cc5ccccc5)cc4)cc3)cc2)cc1
InChIInChI=1S/C32H26/c1-3-7-25(8-4-1)23-27-11-15-29(16-12-27)31-19-21-32(22-20-31)30-17-13-28(14-18-30)24-26-9-5-2-6-10-26/h1-22H,23-24H2
InChIKeyCPCIBKIIZAYMBE-UHFFFAOYSA-N
XLogP8.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.56
LogP ≤ 58.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,4-bis(4-benzylphenyl)benzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

phenyl(113C)methylbenzene
CID 11194569
4-(4-benzylphenyl)pyridine
CID 174553937
1,4-dibenzylbenzene;ethane
CID 91406396
1-benzyl-4-[(4-benzylphenyl)methyl]benzene;1,4-dibenzylbenzene;ethane
CID 158067654
1-benzyl-4-(4-phenylphenyl)sulfanylbenzene
CID 59163536
1,4-bis(3-benzylphenyl)benzene
CID 175442136
[4-[(4-phenylphenyl)methyl]phenyl]methanol
CID 141147437
1-benzyl-4-[2-(4-benzylphenyl)ethyl]benzene
CID 23565947
1-benzyl-4-methylbenzene;toluene
CID 144690555
potassium;benzylbenzene;hydride
CID 173011788
1-[4-(4-benzylphenyl)phenyl]ethanone
CID 67858865
benzene;benzylbenzene;1,1'-biphenyl;ethane;naphthalene
CID 160824127

Frequently Asked Questions

What is the IUPAC name of 1,4-bis(4-benzylphenyl)benzene?
The IUPAC name of 1,4-bis(4-benzylphenyl)benzene (CID 58251041) is 1,4-bis(4-benzylphenyl)benzene.
What is the SMILES notation for 1,4-bis(4-benzylphenyl)benzene?
The canonical SMILES for 1,4-bis(4-benzylphenyl)benzene is c1ccc(Cc2ccc(-c3ccc(-c4ccc(Cc5ccccc5)cc4)cc3)cc2)cc1.
What is the InChIKey of 1,4-bis(4-benzylphenyl)benzene?
The InChIKey is CPCIBKIIZAYMBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H26/c1-3-7-25(8-4-1)23-27-11-15-29(16-12-27)31-19-21-32(22-20-31)30-17-13-28(14-18-30)24-26-9-5-2-6-10-26/h1-22H,23-24H2.
What are the key properties of 1,4-bis(4-benzylphenyl)benzene?
1,4-bis(4-benzylphenyl)benzene has a molecular weight of 410.56 g/mol, XLogP of 8.20, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-bis(4-benzylphenyl)benzene is sourced from PubChem (CID 58251041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).