5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole

C25H20Cl2N2O2 — CID 67050125

IUPAC5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole
SMILESCOc1ccc(-c2ccc(C=Cc3ncc(-c4ccc(Cl)cc4Cl)[nH]3)cc2)cc1OC
InChIInChI=1S/C25H20Cl2N2O2/c1-30-23-11-8-18(13-24(23)31-2)17-6-3-16(4-7-17)5-12-25-28-15-22(29-25)20-10-9-19(26)14-21(20)27/h3-15H,1-2H3,(H,28,29)
InChIKeyUMXGLHVBILRLLJ-UHFFFAOYSA-N
MW451.35 g/mol
LogP7.24
Rot. Bonds6

About 5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole

5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole (PubChem CID 67050125) has the molecular formula C25H20Cl2N2O2 and a molecular weight of 451.35 g/mol. Its IUPAC name is 5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole.

Molecular Properties

Compound Name5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole
PubChem CID67050125
Molecular FormulaC25H20Cl2N2O2
Molecular Weight451.35 g/mol
Exact Mass450.09
IUPAC Name5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole
SMILESCOc1ccc(-c2ccc(C=Cc3ncc(-c4ccc(Cl)cc4Cl)[nH]3)cc2)cc1OC
InChIInChI=1S/C25H20Cl2N2O2/c1-30-23-11-8-18(13-24(23)31-2)17-6-3-16(4-7-17)5-12-25-28-15-22(29-25)20-10-9-19(26)14-21(20)27/h3-15H,1-2H3,(H,28,29)
InChIKeyUMXGLHVBILRLLJ-UHFFFAOYSA-N
XLogP7.24
TPSA47.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.35
LogP ≤ 57.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2,4-dichlorophenyl)-2-[2-[4-(2-methoxyphenyl)phenyl]ethenyl]-1H-imidazole
CID 67049019
5-(2,4-dichlorophenyl)-2-[2-[4-(3-methoxyphenyl)phenyl]ethenyl]-1H-imidazole
CID 67049310
2-[2-(4-chlorophenyl)ethenyl]-5-(2,4-dichlorophenyl)-1H-imidazole
CID 67049073
2-[2-[4-(4-butoxyphenyl)phenyl]ethenyl]-5-(2,4-dichlorophenyl)-1H-imidazole
CID 67049515
5-(2-chloro-4-methylphenyl)-2-[(E)-2-[4-(3-methoxyphenyl)phenyl]ethenyl]-1H-imidazole
CID 142933571
4-[2-[2-[4-[4-(3-carboxypropoxy)phenyl]phenyl]ethenyl]-4-(2,4-dichlorophenyl)imidazol-1-yl]butanoic acid;5-(2,4-dichlorophenyl)-2-[2-[4-(4-methoxyphenyl)phenyl]ethenyl]-1H-imidazole
CID 173215481
4-[2-[2-[5-(2,4-dichlorophenyl)-1H-imidazol-2-yl]ethenyl]-4-phenylphenoxy]butanoic acid
CID 67049188
4-[4-[2-[4-[2-[5-(2,4-dichlorophenyl)-1H-imidazol-2-yl]ethenyl]phenyl]ethynyl]phenoxy]butanoic acid
CID 67049177
5-(2,4-dichlorophenyl)-2-[2-[2-fluoro-4-(trifluoromethyl)phenyl]ethenyl]-1H-imidazole
CID 90959734
5-(2,4-dichlorophenyl)-2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-3H-pyrrole
CID 58211935
N'-(4-chlorophenyl)-3-[4-(3,4-dimethoxyphenyl)phenyl]prop-2-enimidamide
CID 72562744
5-(2,4-dichlorophenyl)-2-[(4-methoxyphenyl)methyl]-1H-imidazole
CID 18755567

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole?
The IUPAC name of 5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole (CID 67050125) is 5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole.
What is the SMILES notation for 5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole?
The canonical SMILES for 5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole is COc1ccc(-c2ccc(C=Cc3ncc(-c4ccc(Cl)cc4Cl)[nH]3)cc2)cc1OC.
What is the InChIKey of 5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole?
The InChIKey is UMXGLHVBILRLLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20Cl2N2O2/c1-30-23-11-8-18(13-24(23)31-2)17-6-3-16(4-7-17)5-12-25-28-15-22(29-25)20-10-9-19(26)14-21(20)27/h3-15H,1-2H3,(H,28,29).
What are the key properties of 5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole?
5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole has a molecular weight of 451.35 g/mol, XLogP of 7.24, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dichlorophenyl)-2-[2-[4-(3,4-dimethoxyphenyl)phenyl]ethenyl]-1H-imidazole is sourced from PubChem (CID 67050125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).