4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole

C25H20Cl2N2 — CID 141094164

IUPAC4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole
SMILESCCn1cc(-c2ccc(Cl)cc2Cl)nc1/C=C/c1cccc(-c2ccccc2)c1
InChIInChI=1S/C25H20Cl2N2/c1-2-29-17-24(22-13-12-21(26)16-23(22)27)28-25(29)14-11-18-7-6-10-20(15-18)19-8-4-3-5-9-19/h3-17H,2H2,1H3/b14-11+
InChIKeyNUTXLAUHUZHNRF-SDNWHVSQSA-N
MW419.36 g/mol
LogP7.71
Rot. Bonds5

About 4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole

4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole (PubChem CID 141094164) has the molecular formula C25H20Cl2N2 and a molecular weight of 419.36 g/mol. Its IUPAC name is 4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole.

Molecular Properties

Compound Name4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole
PubChem CID141094164
Molecular FormulaC25H20Cl2N2
Molecular Weight419.36 g/mol
Exact Mass418.10
IUPAC Name4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole
SMILESCCn1cc(-c2ccc(Cl)cc2Cl)nc1/C=C/c1cccc(-c2ccccc2)c1
InChIInChI=1S/C25H20Cl2N2/c1-2-29-17-24(22-13-12-21(26)16-23(22)27)28-25(29)14-11-18-7-6-10-20(15-18)19-8-4-3-5-9-19/h3-17H,2H2,1H3/b14-11+
InChIKeyNUTXLAUHUZHNRF-SDNWHVSQSA-N
XLogP7.71
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500419.36
LogP ≤ 57.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-1-(4-phenylphenyl)prop-1-en-2-yl]imidazole
CID 141094170
1-benzyl-4-(2,4-dichlorophenyl)-2-[2-[4-(4-methoxyphenyl)phenyl]ethenyl]imidazole
CID 67049290
1-ethyl-4-(4-phenylphenyl)-2-[(E)-2-(4-phenylphenyl)ethenyl]imidazole
CID 141094204
4-(2,4-dichlorophenyl)-1-[(4-nitrophenyl)methyl]-2-[(E)-2-phenylethenyl]imidazole
CID 141121321
methyl 3-[4-[2-[4-(2,4-dichlorophenyl)-1-[(4-methoxycarbonylphenyl)methyl]imidazol-2-yl]ethenyl]phenyl]benzoate
CID 67049826
4-(2,4-dichlorophenyl)-1-[(4-methylsulfonylphenyl)methyl]-2-[2-[4-(3-methylsulfonylphenyl)phenyl]ethenyl]imidazole
CID 67049428
5-[4-[4-[2-[4-(2,4-dichlorophenyl)-1-ethylimidazol-2-yl]ethenyl]phenyl]phenoxy]furan-2-carboxylic acid
CID 67049098
4-[[4-(2,4-dichlorophenyl)-2-[(E)-2-[4-(3-methylsulfanylphenyl)phenyl]ethenyl]imidazol-1-yl]methyl]benzoic acid
CID 142933599
4-[3-[3-[(E)-2-[4-(2,4-dichlorophenyl)-1-ethylimidazol-2-yl]ethenyl]-4-methoxyphenyl]phenoxy]butanoic acid
CID 58211836
4-[[4-[4-[2-[4-(2,4-dichlorophenyl)-1-ethylimidazol-2-yl]ethenyl]phenyl]-2-fluorophenoxy]methyl]benzoic acid
CID 67048938
4-[4-[4-[(E)-2-[4-(2,4-dichlorophenyl)-1-ethylimidazol-2-yl]ethenyl]phenyl]phenoxy]-2-(trifluoromethyl)benzoic acid
CID 58212033
1-butyl-4-(2,4-dichlorophenyl)-2-[(E)-2-[4-(4-methoxyphenyl)phenyl]ethenyl]imidazole
CID 58211809

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole?
The IUPAC name of 4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole (CID 141094164) is 4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole.
What is the SMILES notation for 4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole?
The canonical SMILES for 4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole is CCn1cc(-c2ccc(Cl)cc2Cl)nc1/C=C/c1cccc(-c2ccccc2)c1.
What is the InChIKey of 4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole?
The InChIKey is NUTXLAUHUZHNRF-SDNWHVSQSA-N. The full InChI is InChI=1S/C25H20Cl2N2/c1-2-29-17-24(22-13-12-21(26)16-23(22)27)28-25(29)14-11-18-7-6-10-20(15-18)19-8-4-3-5-9-19/h3-17H,2H2,1H3/b14-11+.
What are the key properties of 4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole?
4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole has a molecular weight of 419.36 g/mol, XLogP of 7.71, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-2-(3-phenylphenyl)ethenyl]imidazole is sourced from PubChem (CID 141094164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).