1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene

C25H20 — CID 58879503

IUPAC1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
SMILESCc1cccc(-c2ccc(-c3ccc(-c4ccccc4)cc3)cc2)c1
InChIInChI=1S/C25H20/c1-19-6-5-9-25(18-19)24-16-14-23(15-17-24)22-12-10-21(11-13-22)20-7-3-2-4-8-20/h2-18H,1H3
InChIKeyHXILGGLWWGQSKV-UHFFFAOYSA-N
MW320.44 g/mol
LogP7.00
Rot. Bonds3

About 1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene

1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene (PubChem CID 58879503) has the molecular formula C25H20 and a molecular weight of 320.44 g/mol. Its IUPAC name is 1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene.

Molecular Properties

Compound Name1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
PubChem CID58879503
Molecular FormulaC25H20
Molecular Weight320.44 g/mol
Exact Mass320.16
IUPAC Name1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
SMILESCc1cccc(-c2ccc(-c3ccc(-c4ccccc4)cc3)cc2)c1
InChIInChI=1S/C25H20/c1-19-6-5-9-25(18-19)24-16-14-23(15-17-24)22-12-10-21(11-13-22)20-7-3-2-4-8-20/h2-18H,1H3
InChIKeyHXILGGLWWGQSKV-UHFFFAOYSA-N
XLogP7.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.44
LogP ≤ 57.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-methyl-3-[4-(4-phenylphenyl)phenyl]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

ethane;1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
CID 142439051
1-methyl-3-[3-[3-(4-phenylphenyl)phenyl]phenyl]benzene
CID 153438411
ethane;1-methyl-3-phenylbenzene
CID 142040878
1-(3-methylphenyl)-3-phenyl-5-(3-phenylphenyl)benzene
CID 123280286
ethane;1-methyl-3-(3-phenylphenyl)benzene
CID 163289488
1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene
CID 123283333
ethane;methane;1-methyl-3-phenylbenzene
CID 144644852
methanamine;1-methyl-3-phenylbenzene
CID 145414985
ethene;1-methyl-3-phenylbenzene
CID 142622149
1,1'-biphenyl;1,3-diphenylbenzene;1,4-diphenylbenzene;ethane;toluene
CID 165006736
1-methyl-3-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene
CID 58892418
methane;1-methyl-3-(4-methylphenyl)benzene
CID 158328523

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene?
The IUPAC name of 1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene (CID 58879503) is 1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene.
What is the SMILES notation for 1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene?
The canonical SMILES for 1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene is Cc1cccc(-c2ccc(-c3ccc(-c4ccccc4)cc3)cc2)c1.
What is the InChIKey of 1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene?
The InChIKey is HXILGGLWWGQSKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20/c1-19-6-5-9-25(18-19)24-16-14-23(15-17-24)22-12-10-21(11-13-22)20-7-3-2-4-8-20/h2-18H,1H3.
What are the key properties of 1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene?
1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene has a molecular weight of 320.44 g/mol, XLogP of 7.00, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene is sourced from PubChem (CID 58879503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).