[2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone

C27H22O — CID 2825389

IUPAC[2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone
SMILESCc1ccc(-c2cc(-c3ccccc3)cc(C)c2C(=O)c2ccccc2)cc1
InChIInChI=1S/C27H22O/c1-19-13-15-22(16-14-19)25-18-24(21-9-5-3-6-10-21)17-20(2)26(25)27(28)23-11-7-4-8-12-23/h3-18H,1-2H3
InChIKeyWZYKAZVUGCEYAX-UHFFFAOYSA-N
MW362.47 g/mol
LogP6.87
Rot. Bonds4

About [2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone

[2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone (PubChem CID 2825389) has the molecular formula C27H22O and a molecular weight of 362.47 g/mol. Its IUPAC name is [2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone.

Molecular Properties

Compound Name[2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone
PubChem CID2825389
Molecular FormulaC27H22O
Molecular Weight362.47 g/mol
Exact Mass362.17
IUPAC Name[2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone
SMILESCc1ccc(-c2cc(-c3ccccc3)cc(C)c2C(=O)c2ccccc2)cc1
InChIInChI=1S/C27H22O/c1-19-13-15-22(16-14-19)25-18-24(21-9-5-3-6-10-21)17-20(2)26(25)27(28)23-11-7-4-8-12-23/h3-18H,1-2H3
InChIKeyWZYKAZVUGCEYAX-UHFFFAOYSA-N
XLogP6.87
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.47
LogP ≤ 56.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze [2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone 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-(2,4,6-triphenylphenyl)methanone
CID 3631606
4-[2-(2-methyl-4,6-diphenylbenzoyl)-3,5-diphenylphenyl]-1-phenylbut-3-en-1-one
CID 3727587
ethane;[4-[4-[4-[4-(4-methylphenyl)phenyl]phenyl]phenyl]phenyl]-phenylmethanone
CID 159022602
ethane;phenyl-(2,4,6-trimethylphenyl)methanone
CID 90795600
diphenylmethanone;(4-methylphenyl)-phenylmethanone
CID 69336781
(2-methyl-3,4,6-triphenylphenyl)-phenylmethanone
CID 13495520
4-methyl-N-(2,4,6-triphenylphenyl)benzamide
CID 12729541
1,3,5-tris[4-[(E)-2-(4-methylphenyl)-1,2-diphenylethenyl]phenyl]benzene
CID 170669630
1-methyl-4-(4-methylphenyl)-2-phenylbenzene
CID 18683184
(4-methylphenyl)-[4-[2-(4-methylphenyl)phenyl]phenyl]methanone
CID 175461017
phenyl-(4-phenylphenyl)methanone
CID 155775877
1-(4-methylphenyl)-3,5-bis(4-phenylphenyl)benzene
CID 142935427

Frequently Asked Questions

What is the IUPAC name of [2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone?
The IUPAC name of [2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone (CID 2825389) is [2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone.
What is the SMILES notation for [2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone?
The canonical SMILES for [2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone is Cc1ccc(-c2cc(-c3ccccc3)cc(C)c2C(=O)c2ccccc2)cc1.
What is the InChIKey of [2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone?
The InChIKey is WZYKAZVUGCEYAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22O/c1-19-13-15-22(16-14-19)25-18-24(21-9-5-3-6-10-21)17-20(2)26(25)27(28)23-11-7-4-8-12-23/h3-18H,1-2H3.
What are the key properties of [2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone?
[2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone has a molecular weight of 362.47 g/mol, XLogP of 6.87, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone is sourced from PubChem (CID 2825389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).