2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole

C23H19BrN2 — CID 20577238

IUPAC2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole
SMILESCCn1c(-c2ccccc2Br)nc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C23H19BrN2/c1-2-26-22(18-13-7-4-8-14-18)21(17-11-5-3-6-12-17)25-23(26)19-15-9-10-16-20(19)24/h3-16H,2H2,1H3
InChIKeyYJDQNFGDBRIEBX-UHFFFAOYSA-N
MW403.32 g/mol
LogP6.67
Rot. Bonds4

About 2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole

2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole (PubChem CID 20577238) has the molecular formula C23H19BrN2 and a molecular weight of 403.32 g/mol. Its IUPAC name is 2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole.

Molecular Properties

Compound Name2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole
PubChem CID20577238
Molecular FormulaC23H19BrN2
Molecular Weight403.32 g/mol
Exact Mass402.07
IUPAC Name2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole
SMILESCCn1c(-c2ccccc2Br)nc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C23H19BrN2/c1-2-26-22(18-13-7-4-8-14-18)21(17-11-5-3-6-12-17)25-23(26)19-15-9-10-16-20(19)24/h3-16H,2H2,1H3
InChIKeyYJDQNFGDBRIEBX-UHFFFAOYSA-N
XLogP6.67
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500403.32
LogP ≤ 56.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromophenyl)-1-ethyl-4,5-diphenylimidazole
CID 11825610
2-[2-(2-bromophenyl)-4,5-diphenylimidazol-1-yl]ethyl acetate
CID 20821454
2-[2-(2-bromophenyl)-4,5-diphenylimidazol-1-yl]acetic acid;2-[3-[2-[1-(carboxymethyl)-4,5-diphenylimidazol-2-yl]phenyl]anilino]acetic acid;methane
CID 159380134
3-[2-(4,5-diphenyl-1-propylimidazol-2-yl)phenyl]aniline
CID 20577315
1-ethyl-2,4-diphenyl-5-thiophen-2-ylimidazole
CID 122227297
2-(2-diphenylphosphorylnaphthalen-1-yl)-1-ethyl-4,5-diphenylimidazole
CID 134590299
2-[2-[2-(3-aminophenyl)phenyl]-4,5-diphenylimidazol-1-yl]ethanol
CID 20577222
2-[3-[2-(1-ethyl-4,5-diphenylimidazol-2-yl)phenyl]anilino]acetonitrile;3-[2-(1-ethyl-4,5-diphenylimidazol-2-yl)phenyl]-N-(2H-tetrazol-5-ylmethyl)aniline;methane
CID 158174166
1-methyl-2-[4-(1-methyl-4,5-diphenylimidazol-2-yl)phenyl]-4,5-diphenylimidazole
CID 102256803
dihydroxy(oxo)phosphanium;1-heptyl-2,4,5-triphenylimidazole
CID 70277555
3-(1-benzyl-4,5-diphenylimidazol-2-yl)phenol
CID 11014921
1,4,5-triphenyl-2-(1,4,5-triphenylimidazol-2-yl)imidazole
CID 19020129

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole?
The IUPAC name of 2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole (CID 20577238) is 2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole.
What is the SMILES notation for 2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole?
The canonical SMILES for 2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole is CCn1c(-c2ccccc2Br)nc(-c2ccccc2)c1-c1ccccc1.
What is the InChIKey of 2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole?
The InChIKey is YJDQNFGDBRIEBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19BrN2/c1-2-26-22(18-13-7-4-8-14-18)21(17-11-5-3-6-12-17)25-23(26)19-15-9-10-16-20(19)24/h3-16H,2H2,1H3.
What are the key properties of 2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole?
2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole has a molecular weight of 403.32 g/mol, XLogP of 6.67, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-1-ethyl-4,5-diphenylimidazole is sourced from PubChem (CID 20577238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).