5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole

C16H10Cl4N2 — CID 141255849

IUPAC5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole
SMILESClc1ccc(Cc2ncc(-c3ccc(Cl)cc3Cl)[nH]2)c(Cl)c1
InChIInChI=1S/C16H10Cl4N2/c17-10-2-1-9(13(19)6-10)5-16-21-8-15(22-16)12-4-3-11(18)7-14(12)20/h1-4,6-8H,5H2,(H,21,22)
InChIKeyNVOPKCFKQBQGJY-UHFFFAOYSA-N
MW372.08 g/mol
LogP6.28
Rot. Bonds3

About 5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole

5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole (PubChem CID 141255849) has the molecular formula C16H10Cl4N2 and a molecular weight of 372.08 g/mol. Its IUPAC name is 5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole.

Molecular Properties

Compound Name5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole
PubChem CID141255849
Molecular FormulaC16H10Cl4N2
Molecular Weight372.08 g/mol
Exact Mass369.96
IUPAC Name5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole
SMILESClc1ccc(Cc2ncc(-c3ccc(Cl)cc3Cl)[nH]2)c(Cl)c1
InChIInChI=1S/C16H10Cl4N2/c17-10-2-1-9(13(19)6-10)5-16-21-8-15(22-16)12-4-3-11(18)7-14(12)20/h1-4,6-8H,5H2,(H,21,22)
InChIKeyNVOPKCFKQBQGJY-UHFFFAOYSA-N
XLogP6.28
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.08
LogP ≤ 56.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-(2,4-dichlorophenyl)-2-[(4-methoxyphenyl)methyl]-1H-imidazole
CID 18755567
5-[5-(2,4-dichlorophenyl)-1H-imidazol-2-yl]pentan-1-amine
CID 43651166
2-benzyl-5-(2,5-dichlorophenyl)-1H-imidazole
CID 141255834
1-[4-[4-[[5-(2,4-dichlorophenyl)-1H-imidazol-2-yl]methyl]phenyl]phenyl]-4-methylpiperazine
CID 141180579
2-[(2-chlorophenyl)methyl]-5-(2,3-dichlorophenyl)-1H-imidazole
CID 141255841
[5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol
CID 116878314
2-[2-(4-chlorophenyl)ethenyl]-5-(2,4-dichlorophenyl)-1H-imidazole
CID 67049073
5-[(2,4-dichlorophenyl)methyl]-2-(phenoxymethyl)-1H-imidazole
CID 139695523
3-(cyclohexylmethoxy)-6-[4-[[5-(2,4-dichlorophenyl)-1H-imidazol-2-yl]methyl]phenyl]pyridazine
CID 141180584
5-(2,4,5-trichlorophenyl)-2-[(3,4,5-trichlorophenyl)methyl]-1H-imidazole
CID 141255867
1-[5-(2,4-dichlorophenyl)-1H-imidazol-2-yl]cyclopentan-1-amine
CID 60853729
5-(2,3-dichlorophenyl)-2-[(3,5-dichlorophenyl)methyl]-1H-imidazole
CID 141255824

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole?
The IUPAC name of 5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole (CID 141255849) is 5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole.
What is the SMILES notation for 5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole?
The canonical SMILES for 5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole is Clc1ccc(Cc2ncc(-c3ccc(Cl)cc3Cl)[nH]2)c(Cl)c1.
What is the InChIKey of 5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole?
The InChIKey is NVOPKCFKQBQGJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl4N2/c17-10-2-1-9(13(19)6-10)5-16-21-8-15(22-16)12-4-3-11(18)7-14(12)20/h1-4,6-8H,5H2,(H,21,22).
What are the key properties of 5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole?
5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole has a molecular weight of 372.08 g/mol, XLogP of 6.28, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methyl]-1H-imidazole is sourced from PubChem (CID 141255849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).