1,2-bis(3,5-diphenylphenyl)imidazole

C39H28N2 — CID 90181054

IUPAC1,2-bis(3,5-diphenylphenyl)imidazole
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3nccn3-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2)cc1
InChIInChI=1S/C39H28N2/c1-5-13-29(14-6-1)33-23-34(30-15-7-2-8-16-30)26-37(25-33)39-40-21-22-41(39)38-27-35(31-17-9-3-10-18-31)24-36(28-38)32-19-11-4-12-20-32/h1-28H
InChIKeyAIFGSPINACYDPW-UHFFFAOYSA-N
MW524.67 g/mol
LogP10.21
Rot. Bonds6

About 1,2-bis(3,5-diphenylphenyl)imidazole

1,2-bis(3,5-diphenylphenyl)imidazole (PubChem CID 90181054) has the molecular formula C39H28N2 and a molecular weight of 524.67 g/mol. Its IUPAC name is 1,2-bis(3,5-diphenylphenyl)imidazole.

Molecular Properties

Compound Name1,2-bis(3,5-diphenylphenyl)imidazole
PubChem CID90181054
Molecular FormulaC39H28N2
Molecular Weight524.67 g/mol
Exact Mass524.23
IUPAC Name1,2-bis(3,5-diphenylphenyl)imidazole
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3nccn3-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2)cc1
InChIInChI=1S/C39H28N2/c1-5-13-29(14-6-1)33-23-34(30-15-7-2-8-16-30)26-37(25-33)39-40-21-22-41(39)38-27-35(31-17-9-3-10-18-31)24-36(28-38)32-19-11-4-12-20-32/h1-28H
InChIKeyAIFGSPINACYDPW-UHFFFAOYSA-N
XLogP10.21
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500524.67
LogP ≤ 510.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenyl-2-(3-phenylphenyl)imidazole
CID 157490154
1-phenyl-2-[3-(1-phenylimidazol-2-yl)phenyl]imidazole
CID 58965505
3-(1-phenylimidazol-2-yl)phenol
CID 70654534
2-(3-bromophenyl)-1-phenylimidazole
CID 70654369
2-phenyl-4-(4-phenylphenyl)-5-[2-[3-[1-(6-phenyl-3-pyridinyl)imidazol-2-yl]-5-[2-(6-phenyl-3-pyridinyl)imidazol-1-yl]phenyl]phenyl]pyridine
CID 153458098
2-phenyl-5-[2-[3-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]-5-[1-(6-phenyl-3-pyridinyl)imidazol-2-yl]phenyl]imidazol-1-yl]pyridine
CID 142438949
N,N-dimethyl-4-(2-phenylimidazol-1-yl)aniline
CID 59348233
9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole
CID 140799910
1-[2,6-bis(2-methylpropyl)-4-phenylphenyl]-2-phenylimidazole
CID 58175669
4-[2-(3-fluorophenyl)imidazol-1-yl]pyridine
CID 57036251
9-[4-(1-phenylimidazol-2-yl)phenyl]carbazole
CID 140800069
1-(3-methoxy-4-propan-2-ylphenyl)-2-phenylimidazole
CID 156877703

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(3,5-diphenylphenyl)imidazole?
The IUPAC name of 1,2-bis(3,5-diphenylphenyl)imidazole (CID 90181054) is 1,2-bis(3,5-diphenylphenyl)imidazole.
What is the SMILES notation for 1,2-bis(3,5-diphenylphenyl)imidazole?
The canonical SMILES for 1,2-bis(3,5-diphenylphenyl)imidazole is c1ccc(-c2cc(-c3ccccc3)cc(-c3nccn3-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2)cc1.
What is the InChIKey of 1,2-bis(3,5-diphenylphenyl)imidazole?
The InChIKey is AIFGSPINACYDPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H28N2/c1-5-13-29(14-6-1)33-23-34(30-15-7-2-8-16-30)26-37(25-33)39-40-21-22-41(39)38-27-35(31-17-9-3-10-18-31)24-36(28-38)32-19-11-4-12-20-32/h1-28H.
What are the key properties of 1,2-bis(3,5-diphenylphenyl)imidazole?
1,2-bis(3,5-diphenylphenyl)imidazole has a molecular weight of 524.67 g/mol, XLogP of 10.21, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(3,5-diphenylphenyl)imidazole is sourced from PubChem (CID 90181054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).