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

C24H18Cl2N2O — CID 67049019

IUPAC5-(2,4-dichlorophenyl)-2-[2-[4-(2-methoxyphenyl)phenyl]ethenyl]-1H-imidazole
SMILESCOc1ccccc1-c1ccc(C=Cc2ncc(-c3ccc(Cl)cc3Cl)[nH]2)cc1
InChIInChI=1S/C24H18Cl2N2O/c1-29-23-5-3-2-4-19(23)17-9-6-16(7-10-17)8-13-24-27-15-22(28-24)20-12-11-18(25)14-21(20)26/h2-15H,1H3,(H,27,28)
InChIKeyIWEBDPWUKOSYBC-UHFFFAOYSA-N
MW421.33 g/mol
LogP7.23
Rot. Bonds5

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

5-(2,4-dichlorophenyl)-2-[2-[4-(2-methoxyphenyl)phenyl]ethenyl]-1H-imidazole (PubChem CID 67049019) has the molecular formula C24H18Cl2N2O and a molecular weight of 421.33 g/mol. Its IUPAC name is 5-(2,4-dichlorophenyl)-2-[2-[4-(2-methoxyphenyl)phenyl]ethenyl]-1H-imidazole.

Molecular Properties

Compound Name5-(2,4-dichlorophenyl)-2-[2-[4-(2-methoxyphenyl)phenyl]ethenyl]-1H-imidazole
PubChem CID67049019
Molecular FormulaC24H18Cl2N2O
Molecular Weight421.33 g/mol
Exact Mass420.08
IUPAC Name5-(2,4-dichlorophenyl)-2-[2-[4-(2-methoxyphenyl)phenyl]ethenyl]-1H-imidazole
SMILESCOc1ccccc1-c1ccc(C=Cc2ncc(-c3ccc(Cl)cc3Cl)[nH]2)cc1
InChIInChI=1S/C24H18Cl2N2O/c1-29-23-5-3-2-4-19(23)17-9-6-16(7-10-17)8-13-24-27-15-22(28-24)20-12-11-18(25)14-21(20)26/h2-15H,1H3,(H,27,28)
InChIKeyIWEBDPWUKOSYBC-UHFFFAOYSA-N
XLogP7.23
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.33
LogP ≤ 57.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dichlorophenyl)-2-[2-[4-(2-methoxyphenyl)phenyl]ethenyl]-1H-imidazole?
The IUPAC name of 5-(2,4-dichlorophenyl)-2-[2-[4-(2-methoxyphenyl)phenyl]ethenyl]-1H-imidazole (CID 67049019) is 5-(2,4-dichlorophenyl)-2-[2-[4-(2-methoxyphenyl)phenyl]ethenyl]-1H-imidazole.
What is the SMILES notation for 5-(2,4-dichlorophenyl)-2-[2-[4-(2-methoxyphenyl)phenyl]ethenyl]-1H-imidazole?
The canonical SMILES for 5-(2,4-dichlorophenyl)-2-[2-[4-(2-methoxyphenyl)phenyl]ethenyl]-1H-imidazole is COc1ccccc1-c1ccc(C=Cc2ncc(-c3ccc(Cl)cc3Cl)[nH]2)cc1.
What is the InChIKey of 5-(2,4-dichlorophenyl)-2-[2-[4-(2-methoxyphenyl)phenyl]ethenyl]-1H-imidazole?
The InChIKey is IWEBDPWUKOSYBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18Cl2N2O/c1-29-23-5-3-2-4-19(23)17-9-6-16(7-10-17)8-13-24-27-15-22(28-24)20-12-11-18(25)14-21(20)26/h2-15H,1H3,(H,27,28).
What are the key properties of 5-(2,4-dichlorophenyl)-2-[2-[4-(2-methoxyphenyl)phenyl]ethenyl]-1H-imidazole?
5-(2,4-dichlorophenyl)-2-[2-[4-(2-methoxyphenyl)phenyl]ethenyl]-1H-imidazole has a molecular weight of 421.33 g/mol, XLogP of 7.23, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dichlorophenyl)-2-[2-[4-(2-methoxyphenyl)phenyl]ethenyl]-1H-imidazole is sourced from PubChem (CID 67049019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).