4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole

C29H24N2O2 — CID 151753479

IUPAC4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole
SMILESCOc1cccc(-c2nc(-c3ccccc3-c3ccccc3)[nH]c2-c2cccc(OC)c2)c1
InChIInChI=1S/C29H24N2O2/c1-32-23-14-8-12-21(18-23)27-28(22-13-9-15-24(19-22)33-2)31-29(30-27)26-17-7-6-16-25(26)20-10-4-3-5-11-20/h3-19H,1-2H3,(H,30,31)
InChIKeyRPAXYDQWNDVYOS-UHFFFAOYSA-N
MW432.52 g/mol
LogP7.09
Rot. Bonds6

About 4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole

4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole (PubChem CID 151753479) has the molecular formula C29H24N2O2 and a molecular weight of 432.52 g/mol. Its IUPAC name is 4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole.

Molecular Properties

Compound Name4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole
PubChem CID151753479
Molecular FormulaC29H24N2O2
Molecular Weight432.52 g/mol
Exact Mass432.18
IUPAC Name4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole
SMILESCOc1cccc(-c2nc(-c3ccccc3-c3ccccc3)[nH]c2-c2cccc(OC)c2)c1
InChIInChI=1S/C29H24N2O2/c1-32-23-14-8-12-21(18-23)27-28(22-13-9-15-24(19-22)33-2)31-29(30-27)26-17-7-6-16-25(26)20-10-4-3-5-11-20/h3-19H,1-2H3,(H,30,31)
InChIKeyRPAXYDQWNDVYOS-UHFFFAOYSA-N
XLogP7.09
TPSA47.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.52
LogP ≤ 57.09
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

2-(2,5-dimethoxyphenyl)-4,5-bis(3-methoxyphenyl)-1H-imidazole
CID 6618129
4-(3,4-dimethylphenyl)-2-(3-methoxyphenyl)-5-phenyl-1H-imidazole
CID 1110224
4-[2-(3-methoxyphenyl)-4-phenyl-1H-imidazol-5-yl]pyridine
CID 10019342
2-[2-fluoro-4-(trifluoromethyl)phenyl]-4,5-bis(3-methoxyphenyl)-1H-imidazole
CID 141217433
2-(2,4-dimethoxyphenyl)-4,5-diphenyl-1H-imidazole
CID 1036272
2-[2-(3-methoxyphenyl)phenyl]-3H-quinazolin-4-one
CID 168551424
3-[4,5-bis(3-methoxyphenyl)-1H-imidazol-2-yl]-5-bromo-1H-indole
CID 58875260
2-(2,5-dimethoxyphenyl)-4-[4-[2-(2,5-dimethoxyphenyl)-5-phenyl-1H-imidazol-4-yl]phenyl]-5-phenyl-1H-imidazole
CID 135537331
2-(3-methoxyphenyl)-4-phenyl-1H-benzimidazole
CID 67700027
2,5-bis(2-chlorophenyl)-4-(3-methoxy-4-methylphenyl)-1H-imidazole;2-(2-chlorophenyl)-4,5-diphenyl-1H-imidazole;ethane
CID 162284056
2-[2-(4,5-diphenyl-1H-imidazol-2-yl)-4,5-dimethoxyphenyl]-4,5-diphenyl-1H-imidazole
CID 118411404
3-amino-5,6-bis(3-methoxyphenyl)-1H-pyrazin-2-one
CID 132588517

Frequently Asked Questions

What is the IUPAC name of 4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole?
The IUPAC name of 4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole (CID 151753479) is 4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole.
What is the SMILES notation for 4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole?
The canonical SMILES for 4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole is COc1cccc(-c2nc(-c3ccccc3-c3ccccc3)[nH]c2-c2cccc(OC)c2)c1.
What is the InChIKey of 4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole?
The InChIKey is RPAXYDQWNDVYOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H24N2O2/c1-32-23-14-8-12-21(18-23)27-28(22-13-9-15-24(19-22)33-2)31-29(30-27)26-17-7-6-16-25(26)20-10-4-3-5-11-20/h3-19H,1-2H3,(H,30,31).
What are the key properties of 4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole?
4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole has a molecular weight of 432.52 g/mol, XLogP of 7.09, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis(3-methoxyphenyl)-2-(2-phenylphenyl)-1H-imidazole is sourced from PubChem (CID 151753479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).