Home > Compound List > Compound details
7189-82-4 molecular structure
click picture or here to close

2-(2-chlorophenyl)-1-[2-(2-chlorophenyl)-4,5-diphenyl-2H-imidazol-2-yl]-4,5-diphenyl-1H-imidazole

ChemBase ID: 798361
Molecular Formular: C42H28Cl2N4
Molecular Mass: 659.60452
Monoisotopic Mass: 658.16910228
SMILES and InChIs

SMILES:
n1(c(nc(c1c1ccccc1)c1ccccc1)c1c(cccc1)Cl)C1(N=C(C(=N1)c1ccccc1)c1ccccc1)c1c(cccc1)Cl
Canonical SMILES:
Clc1ccccc1c1nc(c(n1C1(N=C(C(=N1)c1ccccc1)c1ccccc1)c1ccccc1Cl)c1ccccc1)c1ccccc1
InChI:
InChI=1S/C42H28Cl2N4/c43-35-27-15-13-25-33(35)41-45-39(31-21-9-3-10-22-31)40(32-23-11-4-12-24-32)48(41)42(34-26-14-16-28-36(34)44)46-37(29-17-5-1-6-18-29)38(47-42)30-19-7-2-8-20-30/h1-28H
InChIKey:
MHDULSOPQSUKBQ-UHFFFAOYSA-N

Cite this record

CBID:798361 http://www.chembase.cn/molecule-798361.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-(2-chlorophenyl)-1-[2-(2-chlorophenyl)-4,5-diphenyl-2H-imidazol-2-yl]-4,5-diphenyl-1H-imidazole
IUPAC Traditional name
2-(2-chlorophenyl)-1-[2-(2-chlorophenyl)-4,5-diphenylimidazol-2-yl]-4,5-diphenylimidazole
Synonyms
2,2'-bis(2-chlorophenyl)-4,4',5,5'-tetraphenyl-1,2'-biimidazole
CAS Number
7189-82-4

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
A&J Pharmtech AJA-O11008 external link Add to cart
Data Source Data ID Price
A&J Pharmtech
AJA-O11008 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 12.624013  LogD (pH = 7.4) 12.644396 
Log P 12.644662  Molar Refractivity 205.8487 cm3
Polarizability 78.23012 Å3 Polar Surface Area 42.54 Å2
Rotatable Bonds Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
98% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle