2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole

C29H22Cl2N2 — CID 142084638

IUPAC2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole
SMILESCC(c1ccccc1Cl)n1c(-c2ccccc2Cl)nc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C29H22Cl2N2/c1-20(23-16-8-10-18-25(23)30)33-28(22-14-6-3-7-15-22)27(21-12-4-2-5-13-21)32-29(33)24-17-9-11-19-26(24)31/h2-20H,1H3
InChIKeyHZJQGNSGAFDNQP-UHFFFAOYSA-N
MW469.42 g/mol
LogP8.80
Rot. Bonds5

About 2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole

2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole (PubChem CID 142084638) has the molecular formula C29H22Cl2N2 and a molecular weight of 469.42 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole.

Molecular Properties

Compound Name2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole
PubChem CID142084638
Molecular FormulaC29H22Cl2N2
Molecular Weight469.42 g/mol
Exact Mass468.12
IUPAC Name2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole
SMILESCC(c1ccccc1Cl)n1c(-c2ccccc2Cl)nc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C29H22Cl2N2/c1-20(23-16-8-10-18-25(23)30)33-28(22-14-6-3-7-15-22)27(21-12-4-2-5-13-21)32-29(33)24-17-9-11-19-26(24)31/h2-20H,1H3
InChIKeyHZJQGNSGAFDNQP-UHFFFAOYSA-N
XLogP8.80
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500469.42
LogP ≤ 58.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole?
The IUPAC name of 2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole (CID 142084638) is 2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole.
What is the SMILES notation for 2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole?
The canonical SMILES for 2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole is CC(c1ccccc1Cl)n1c(-c2ccccc2Cl)nc(-c2ccccc2)c1-c1ccccc1.
What is the InChIKey of 2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole?
The InChIKey is HZJQGNSGAFDNQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H22Cl2N2/c1-20(23-16-8-10-18-25(23)30)33-28(22-14-6-3-7-15-22)27(21-12-4-2-5-13-21)32-29(33)24-17-9-11-19-26(24)31/h2-20H,1H3.
What are the key properties of 2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole?
2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole has a molecular weight of 469.42 g/mol, XLogP of 8.80, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-1-[1-(2-chlorophenyl)ethyl]-4,5-diphenylimidazole is sourced from PubChem (CID 142084638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).