1-[phenyl-(4-phenylphenyl)methyl]imidazole

C22H18N2 — CID 2378

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IUPAC1-[phenyl-(4-phenylphenyl)methyl]imidazole
SMILESc1ccc(-c2ccc(C(c3ccccc3)n3ccnc3)cc2)cc1
InChIInChI=1S/C22H18N2/c1-3-7-18(8-4-1)19-11-13-21(14-12-19)22(24-16-15-23-17-24)20-9-5-2-6-10-20/h1-17,22H
InChIKeyOCAPBUJLXMYKEJ-UHFFFAOYSA-N
MW310.40 g/mol
LogP5.19
Rot. Bonds4

About 1-[phenyl-(4-phenylphenyl)methyl]imidazole

1-[phenyl-(4-phenylphenyl)methyl]imidazole (PubChem CID 2378) has the molecular formula C22H18N2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 1-[phenyl-(4-phenylphenyl)methyl]imidazole.

Molecular Properties

Compound Name1-[phenyl-(4-phenylphenyl)methyl]imidazole
PubChem CID2378
Molecular FormulaC22H18N2
Molecular Weight310.40 g/mol
Exact Mass310.15
IUPAC Name1-[phenyl-(4-phenylphenyl)methyl]imidazole
SMILESc1ccc(-c2ccc(C(c3ccccc3)n3ccnc3)cc2)cc1
InChIInChI=1S/C22H18N2/c1-3-7-18(8-4-1)19-11-13-21(14-12-19)22(24-16-15-23-17-24)20-9-5-2-6-10-20/h1-17,22H
InChIKeyOCAPBUJLXMYKEJ-UHFFFAOYSA-N
XLogP5.19
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.40
LogP ≤ 55.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Clotrimazole
CID 2812
1-Benzylimidazole
CID 77918
Flutrimazole
CID 3401
1H-Imidazole, 2-methyl-1-(phenylmethyl)-
CID 83699
1-Benzyl-3-methylimidazolium Chloride
CID 10560335
1-benzyl-5-phenyl-1H-imidazole
CID 10444038
1-Benzyl-3-cetyl-2-methylimidazolium iodide
CID 10436839
1-(3,4-dihydronaphthalen-2-yl)-1H-imidazole
CID 3021558
4-(Imidazol-1-ylmethyl)benzonitrile
CID 1236449
Dechloroclotrimazole
CID 618231
Efetozole
CID 208911
4-(1-Imidazol-1-yl-vinyl)-benzonitrile
CID 11819989

Frequently Asked Questions

What is the IUPAC name of 1-[phenyl-(4-phenylphenyl)methyl]imidazole?
The IUPAC name of 1-[phenyl-(4-phenylphenyl)methyl]imidazole (CID 2378) is 1-[phenyl-(4-phenylphenyl)methyl]imidazole.
What is the SMILES notation for 1-[phenyl-(4-phenylphenyl)methyl]imidazole?
The canonical SMILES for 1-[phenyl-(4-phenylphenyl)methyl]imidazole is c1ccc(-c2ccc(C(c3ccccc3)n3ccnc3)cc2)cc1.
What is the InChIKey of 1-[phenyl-(4-phenylphenyl)methyl]imidazole?
The InChIKey is OCAPBUJLXMYKEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2/c1-3-7-18(8-4-1)19-11-13-21(14-12-19)22(24-16-15-23-17-24)20-9-5-2-6-10-20/h1-17,22H.
What are the key properties of 1-[phenyl-(4-phenylphenyl)methyl]imidazole?
1-[phenyl-(4-phenylphenyl)methyl]imidazole has a molecular weight of 310.40 g/mol, XLogP of 5.19, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[phenyl-(4-phenylphenyl)methyl]imidazole is sourced from PubChem (CID 2378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).