2-(4-chlorophenyl)-1,4-diphenylimidazole

C21H15ClN2 — CID 44632179

IUPAC2-(4-chlorophenyl)-1,4-diphenylimidazole
SMILESClc1ccc(-c2nc(-c3ccccc3)cn2-c2ccccc2)cc1
InChIInChI=1S/C21H15ClN2/c22-18-13-11-17(12-14-18)21-23-20(16-7-3-1-4-8-16)15-24(21)19-9-5-2-6-10-19/h1-15H
InChIKeyZFUHXEOWYDQDQH-UHFFFAOYSA-N
MW330.82 g/mol
LogP5.86
Rot. Bonds3

About 2-(4-chlorophenyl)-1,4-diphenylimidazole

2-(4-chlorophenyl)-1,4-diphenylimidazole (PubChem CID 44632179) has the molecular formula C21H15ClN2 and a molecular weight of 330.82 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-1,4-diphenylimidazole.

Molecular Properties

Compound Name2-(4-chlorophenyl)-1,4-diphenylimidazole
PubChem CID44632179
Molecular FormulaC21H15ClN2
Molecular Weight330.82 g/mol
Exact Mass330.09
IUPAC Name2-(4-chlorophenyl)-1,4-diphenylimidazole
SMILESClc1ccc(-c2nc(-c3ccccc3)cn2-c2ccccc2)cc1
InChIInChI=1S/C21H15ClN2/c22-18-13-11-17(12-14-18)21-23-20(16-7-3-1-4-8-16)15-24(21)19-9-5-2-6-10-19/h1-15H
InChIKeyZFUHXEOWYDQDQH-UHFFFAOYSA-N
XLogP5.86
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.82
LogP ≤ 55.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-1,4-diphenylimidazole?
The IUPAC name of 2-(4-chlorophenyl)-1,4-diphenylimidazole (CID 44632179) is 2-(4-chlorophenyl)-1,4-diphenylimidazole.
What is the SMILES notation for 2-(4-chlorophenyl)-1,4-diphenylimidazole?
The canonical SMILES for 2-(4-chlorophenyl)-1,4-diphenylimidazole is Clc1ccc(-c2nc(-c3ccccc3)cn2-c2ccccc2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-1,4-diphenylimidazole?
The InChIKey is ZFUHXEOWYDQDQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15ClN2/c22-18-13-11-17(12-14-18)21-23-20(16-7-3-1-4-8-16)15-24(21)19-9-5-2-6-10-19/h1-15H.
What are the key properties of 2-(4-chlorophenyl)-1,4-diphenylimidazole?
2-(4-chlorophenyl)-1,4-diphenylimidazole has a molecular weight of 330.82 g/mol, XLogP of 5.86, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-1,4-diphenylimidazole is sourced from PubChem (CID 44632179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).