2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene

C27H32 — CID 158905708

IUPAC2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene
SMILESCC(C)c1cc(C(C)C)c(-c2ccccc2)c(C(C)C)c1-c1ccccc1
InChIInChI=1S/C27H32/c1-18(2)23-17-24(19(3)4)27(22-15-11-8-12-16-22)25(20(5)6)26(23)21-13-9-7-10-14-21/h7-20H,1-6H3
InChIKeyKOCYSPLVHFWYIU-UHFFFAOYSA-N
MW356.55 g/mol
LogP8.39
Rot. Bonds5

About 2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene

2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene (PubChem CID 158905708) has the molecular formula C27H32 and a molecular weight of 356.55 g/mol. Its IUPAC name is 2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene.

Molecular Properties

Compound Name2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene
PubChem CID158905708
Molecular FormulaC27H32
Molecular Weight356.55 g/mol
Exact Mass356.25
IUPAC Name2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene
SMILESCC(C)c1cc(C(C)C)c(-c2ccccc2)c(C(C)C)c1-c1ccccc1
InChIInChI=1S/C27H32/c1-18(2)23-17-24(19(3)4)27(22-15-11-8-12-16-22)25(20(5)6)26(23)21-13-9-7-10-14-21/h7-20H,1-6H3
InChIKeyKOCYSPLVHFWYIU-UHFFFAOYSA-N
XLogP8.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.55
LogP ≤ 58.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2,4-diphenyl-1,3,5-tri(propan-2-yl)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

1,3,5-triphenyl-2,4,6-tri(propan-2-yl)benzene
CID 175984465
diphenyl-[2-[3-phenyl-2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane
CID 122414026
ditert-butyl-[2-[3-phenyl-2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane
CID 122414025
2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene
CID 175465233
2-(2-iodo-3-methoxyphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene
CID 121483081
2-(4-phenylphenyl)-1,3,5-tri(propan-2-yl)benzene
CID 151062491
bis(4-phenyl-3,5-di(propan-2-yl)aniline);hydrate
CID 174678037
ditert-butyl-[3,6-dimethoxy-2-[3-phenyl-2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane
CID 121483098
8-methyl-1-phenyl-2-propan-2-ylazulene
CID 141167204
3-phenyl-4,5-di(propan-2-yl)benzene-1,2-diol
CID 88710522
1-[3-ethyl-2-phenyl-4,6-di(propan-2-yl)phenyl]ethanol
CID 22005163
[2-phenyl-4,6-di(propan-2-yl)-3-propylphenyl]methanol
CID 22005326

Frequently Asked Questions

What is the IUPAC name of 2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene?
The IUPAC name of 2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene (CID 158905708) is 2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene.
What is the SMILES notation for 2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene?
The canonical SMILES for 2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene is CC(C)c1cc(C(C)C)c(-c2ccccc2)c(C(C)C)c1-c1ccccc1.
What is the InChIKey of 2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene?
The InChIKey is KOCYSPLVHFWYIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H32/c1-18(2)23-17-24(19(3)4)27(22-15-11-8-12-16-22)25(20(5)6)26(23)21-13-9-7-10-14-21/h7-20H,1-6H3.
What are the key properties of 2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene?
2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene has a molecular weight of 356.55 g/mol, XLogP of 8.39, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene is sourced from PubChem (CID 158905708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).