5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride

C23H21ClN2O2 — CID 158418618

IUPAC5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride
SMILESCOc1cc(OCc2ccccc2)ccc1-c1cnc(-c2ccccc2)[nH]1.Cl
InChIInChI=1S/C23H20N2O2.ClH/c1-26-22-14-19(27-16-17-8-4-2-5-9-17)12-13-20(22)21-15-24-23(25-21)18-10-6-3-7-11-18;/h2-15H,16H2,1H3,(H,24,25);1H
InChIKeyITRKNITUTLEFBL-UHFFFAOYSA-N
MW392.89 g/mol
LogP5.75
Rot. Bonds6

About 5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride

5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride (PubChem CID 158418618) has the molecular formula C23H21ClN2O2 and a molecular weight of 392.89 g/mol. Its IUPAC name is 5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride.

Molecular Properties

Compound Name5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride
PubChem CID158418618
Molecular FormulaC23H21ClN2O2
Molecular Weight392.89 g/mol
Exact Mass392.13
IUPAC Name5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride
SMILESCOc1cc(OCc2ccccc2)ccc1-c1cnc(-c2ccccc2)[nH]1.Cl
InChIInChI=1S/C23H20N2O2.ClH/c1-26-22-14-19(27-16-17-8-4-2-5-9-17)12-13-20(22)21-15-24-23(25-21)18-10-6-3-7-11-18;/h2-15H,16H2,1H3,(H,24,25);1H
InChIKeyITRKNITUTLEFBL-UHFFFAOYSA-N
XLogP5.75
TPSA47.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.89
LogP ≤ 55.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenyl)-5-(2-methoxy-4-phenylmethoxyphenyl)-1H-imidazole
CID 58510130
5-(2-methoxy-4-phenylmethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]-1H-imidazole
CID 58510131
5-[2-methoxy-4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]-2-[4-(trifluoromethyl)phenyl]-1H-imidazole
CID 88881339
5-[4-[(4-chlorophenyl)methoxy]-2-methoxyphenyl]-2-(3,5-dichlorophenyl)-1H-imidazole;hydrochloride
CID 161435087
4-[[3-methoxy-4-[2-(3-methylphenyl)-1H-imidazol-5-yl]phenoxy]methyl]benzonitrile
CID 70667531
2-(4-chlorophenyl)-5-[4-[(4-isocyanophenyl)methoxy]-2-methoxyphenyl]-1H-imidazole
CID 58510218
5-[2,4-dimethoxy-5-(2-phenyl-1H-imidazol-5-yl)phenyl]-2-phenyl-1H-imidazole;ethane
CID 144664687
5-(2,3-dimethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride
CID 56926255
5-[4-[(4-bromo-2-fluorophenyl)methoxy]-2-methoxyphenyl]-2-(4-methoxyphenyl)-1H-imidazole
CID 58510120
2-[[3-methoxy-4-[2-(4-methylphenyl)-1H-imidazol-5-yl]phenoxy]methyl]-5-(trifluoromethyl)pyridine
CID 70667493
5-[4-[(4-chloro-2-fluorophenyl)methoxy]-2-methoxyphenyl]-2-(3-methylphenyl)-1H-imidazole
CID 58510067
2-fluoro-5-[5-[2-methoxy-4-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]phenyl]-1H-imidazol-2-yl]pyridine
CID 129304135

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride?
The IUPAC name of 5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride (CID 158418618) is 5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride.
What is the SMILES notation for 5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride?
The canonical SMILES for 5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride is COc1cc(OCc2ccccc2)ccc1-c1cnc(-c2ccccc2)[nH]1.Cl.
What is the InChIKey of 5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride?
The InChIKey is ITRKNITUTLEFBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O2.ClH/c1-26-22-14-19(27-16-17-8-4-2-5-9-17)12-13-20(22)21-15-24-23(25-21)18-10-6-3-7-11-18;/h2-15H,16H2,1H3,(H,24,25);1H.
What are the key properties of 5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride?
5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride has a molecular weight of 392.89 g/mol, XLogP of 5.75, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride is sourced from PubChem (CID 158418618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).