1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene

C31H24 — CID 123422549

IUPAC1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene
SMILESCc1cc(-c2ccccc2)cc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)c1
InChIInChI=1S/C31H24/c1-23-17-27(24-11-5-2-6-12-24)19-28(18-23)31-21-29(25-13-7-3-8-14-25)20-30(22-31)26-15-9-4-10-16-26/h2-22H,1H3
InChIKeyDGWUNAHUQFAUJD-UHFFFAOYSA-N
MW396.53 g/mol
LogP8.66
Rot. Bonds4

About 1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene

1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene (PubChem CID 123422549) has the molecular formula C31H24 and a molecular weight of 396.53 g/mol. Its IUPAC name is 1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene.

Molecular Properties

Compound Name1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene
PubChem CID123422549
Molecular FormulaC31H24
Molecular Weight396.53 g/mol
Exact Mass396.19
IUPAC Name1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene
SMILESCc1cc(-c2ccccc2)cc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)c1
InChIInChI=1S/C31H24/c1-23-17-27(24-11-5-2-6-12-24)19-28(18-23)31-21-29(25-13-7-3-8-14-25)20-30(22-31)26-15-9-4-10-16-26/h2-22H,1H3
InChIKeyDGWUNAHUQFAUJD-UHFFFAOYSA-N
XLogP8.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.53
LogP ≤ 58.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene 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

1-methyl-3-[4-[3-(4-methylphenyl)-5-phenylphenyl]phenyl]-5-phenylbenzene
CID 58892417
1,3-dimethyl-5-phenylbenzene;methane
CID 143325792
1,3-dimethyl-5-(3-phenylphenyl)benzene;sulfane
CID 174481520
1-(4-methylphenyl)-3,5-bis(4-phenylphenyl)benzene
CID 142935427
1,3-dimethyl-5-[3-[3-[3-(3-methylphenyl)-5-phenylphenyl]phenyl]-5-phenylphenyl]benzene
CID 59552812
1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene
CID 123283333
1-(3-methylphenyl)-3-phenyl-5-(3-phenylphenyl)benzene
CID 123280286
ethane;3-methylbicyclo[3.1.0]hexa-1(6),2,4-triene;toluene
CID 142960014
ethane;1,3,5-triphenylbenzene
CID 142123051
1,3,5-triphenylbenzene
CID 158331433
4,9,14,19,24-pentakis-phenylhexacyclo[20.3.1.12,6.17,11.112,16.117,21]triaconta-1(26),2(30),3,5,7(29),8,10,12(28),13,15,17,19,21(27),22,24-pentadecaene
CID 177480216
1-methyl-3,5-bis[3-(4-methylphenyl)phenyl]benzene
CID 59552733

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene?
The IUPAC name of 1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene (CID 123422549) is 1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene.
What is the SMILES notation for 1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene?
The canonical SMILES for 1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene is Cc1cc(-c2ccccc2)cc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)c1.
What is the InChIKey of 1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene?
The InChIKey is DGWUNAHUQFAUJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24/c1-23-17-27(24-11-5-2-6-12-24)19-28(18-23)31-21-29(25-13-7-3-8-14-25)20-30(22-31)26-15-9-4-10-16-26/h2-22H,1H3.
What are the key properties of 1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene?
1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene has a molecular weight of 396.53 g/mol, XLogP of 8.66, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene is sourced from PubChem (CID 123422549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).