4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole

C17H15BrN2O — CID 86178563

IUPAC4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole
SMILESCOCn1c(-c2ccccc2)nc(Br)c1-c1ccccc1
InChIInChI=1S/C17H15BrN2O/c1-21-12-20-15(13-8-4-2-5-9-13)16(18)19-17(20)14-10-6-3-7-11-14/h2-11H,12H2,1H3
InChIKeyDFHZGZRUBOJPSH-UHFFFAOYSA-N
MW343.22 g/mol
LogP4.58
Rot. Bonds4

About 4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole

4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole (PubChem CID 86178563) has the molecular formula C17H15BrN2O and a molecular weight of 343.22 g/mol. Its IUPAC name is 4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole.

Molecular Properties

Compound Name4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole
PubChem CID86178563
Molecular FormulaC17H15BrN2O
Molecular Weight343.22 g/mol
Exact Mass342.04
IUPAC Name4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole
SMILESCOCn1c(-c2ccccc2)nc(Br)c1-c1ccccc1
InChIInChI=1S/C17H15BrN2O/c1-21-12-20-15(13-8-4-2-5-9-13)16(18)19-17(20)14-10-6-3-7-11-14/h2-11H,12H2,1H3
InChIKeyDFHZGZRUBOJPSH-UHFFFAOYSA-N
XLogP4.58
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.22
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[4-bromo-5-(2-chloropyrimidin-4-yl)-2-phenylimidazol-1-yl]methoxy]ethyl-trimethylsilane
CID 59137278
(5-bromo-3-butyl-2-phenylimidazol-4-yl)methanol
CID 18437785
2-(4-bromophenyl)-1-ethyl-4,5-diphenylimidazole
CID 11825610
1-bromo-3-phenylimidazo[5,1-a]isoquinoline
CID 132583639
2-bromo-10-methoxy-8-methyl-3-phenyl-5H-imidazo[1,2-c][1,3]benzoxazine
CID 90273637
2-bromo-3-methoxy-6-phenylpyridine
CID 10869126
[1-(methoxymethyl)benzimidazol-2-yl]methanol
CID 1233949
2-bromo-8-methyl-3-phenyl-5H-imidazo[1,2-c][1,3]benzoxazine
CID 90273635
2-(methoxymethyl)-4,5-diphenyl-1,2,4-triazole-3-thione
CID 10040291
1-(methoxymethyl)benzimidazol-2-amine
CID 12808407
[1-(methoxymethyl)benzimidazol-2-yl]carbamic acid
CID 156529117
1-[(3,4-dimethoxyphenyl)methyl]-2,4,5-triphenylimidazole
CID 134953177

Frequently Asked Questions

What is the IUPAC name of 4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole?
The IUPAC name of 4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole (CID 86178563) is 4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole.
What is the SMILES notation for 4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole?
The canonical SMILES for 4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole is COCn1c(-c2ccccc2)nc(Br)c1-c1ccccc1.
What is the InChIKey of 4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole?
The InChIKey is DFHZGZRUBOJPSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15BrN2O/c1-21-12-20-15(13-8-4-2-5-9-13)16(18)19-17(20)14-10-6-3-7-11-14/h2-11H,12H2,1H3.
What are the key properties of 4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole?
4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole has a molecular weight of 343.22 g/mol, XLogP of 4.58, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-1-(methoxymethyl)-2,5-diphenylimidazole is sourced from PubChem (CID 86178563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).