4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole

C24H22N2O2 — CID 1101727

IUPAC4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole
SMILESCOc1ccc(-c2nc(-c3ccc(C)cc3)[nH]c2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H22N2O2/c1-16-4-6-19(7-5-16)24-25-22(17-8-12-20(27-2)13-9-17)23(26-24)18-10-14-21(28-3)15-11-18/h4-15H,1-3H3,(H,25,26)
InChIKeySFJOFRNEQLJWIM-UHFFFAOYSA-N
MW370.45 g/mol
LogP5.74
Rot. Bonds5

About 4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole

4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole (PubChem CID 1101727) has the molecular formula C24H22N2O2 and a molecular weight of 370.45 g/mol. Its IUPAC name is 4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole.

Molecular Properties

Compound Name4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole
PubChem CID1101727
Molecular FormulaC24H22N2O2
Molecular Weight370.45 g/mol
Exact Mass370.17
IUPAC Name4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole
SMILESCOc1ccc(-c2nc(-c3ccc(C)cc3)[nH]c2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H22N2O2/c1-16-4-6-19(7-5-16)24-25-22(17-8-12-20(27-2)13-9-17)23(26-24)18-10-14-21(28-3)15-11-18/h4-15H,1-3H3,(H,25,26)
InChIKeySFJOFRNEQLJWIM-UHFFFAOYSA-N
XLogP5.74
TPSA47.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.45
LogP ≤ 55.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imidazole_A(19)', 'substructure': 'N/A'}

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Related Compounds

4-(4-methoxyphenyl)-2-[4-[4-(4-methoxyphenyl)-5-phenyl-1H-imidazol-2-yl]phenyl]-5-phenyl-1H-imidazole
CID 136591177
2-(4-bromophenyl)-4,5-bis(4-methoxyphenyl)-1H-imidazole
CID 1101724
4-[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]phenol
CID 1101726
4,5-bis[4-(4-methoxyphenyl)phenyl]-2-phenyl-1H-imidazole
CID 86068927
4-[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]phenol;ethane
CID 142013542
2-(4-methoxyphenyl)-5-(4-methylphenyl)-1H-imidazole-4-thiol
CID 23904808
4,5-bis(4-methoxyphenyl)-2-(1H-pyrrol-3-yl)-1H-imidazole
CID 135968526
4,5-bis(4-methoxyphenyl)-2-(5-methylfuran-2-yl)-1H-imidazole
CID 40532851
[4-[2-(4-methoxyphenyl)-4-phenyl-1H-imidazol-5-yl]phenyl]-[4-[2-(4-methoxyphenyl)-5-phenyl-1H-imidazol-4-yl]phenyl]methanone
CID 135495721
2-(3-chlorophenyl)-4,5-bis(4-methoxyphenyl)-1H-imidazole
CID 1101728
4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)sulfanyl-1H-imidazole
CID 12832321
5-(4-bromophenyl)-2-(4-methylphenyl)-4-phenyl-1H-imidazole
CID 3106859

Frequently Asked Questions

What is the IUPAC name of 4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole?
The IUPAC name of 4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole (CID 1101727) is 4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole.
What is the SMILES notation for 4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole?
The canonical SMILES for 4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole is COc1ccc(-c2nc(-c3ccc(C)cc3)[nH]c2-c2ccc(OC)cc2)cc1.
What is the InChIKey of 4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole?
The InChIKey is SFJOFRNEQLJWIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O2/c1-16-4-6-19(7-5-16)24-25-22(17-8-12-20(27-2)13-9-17)23(26-24)18-10-14-21(28-3)15-11-18/h4-15H,1-3H3,(H,25,26).
What are the key properties of 4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole?
4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole has a molecular weight of 370.45 g/mol, XLogP of 5.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis(4-methoxyphenyl)-2-(4-methylphenyl)-1H-imidazole is sourced from PubChem (CID 1101727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).