2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole

C30H24Cl2N2O2 — CID 3732902

IUPAC2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole
SMILESCOc1ccc(Cn2c(-c3ccc(Cl)cc3)nc(-c3ccc(OC)cc3)c2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C30H24Cl2N2O2/c1-35-26-15-3-20(4-16-26)19-34-29(22-5-11-24(31)12-6-22)28(21-9-17-27(36-2)18-10-21)33-30(34)23-7-13-25(32)14-8-23/h3-18H,19H2,1-2H3
InChIKeyWBNJXEPZHPCEND-UHFFFAOYSA-N
MW515.44 g/mol
LogP8.26
Rot. Bonds7

About 2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole

2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole (PubChem CID 3732902) has the molecular formula C30H24Cl2N2O2 and a molecular weight of 515.44 g/mol. Its IUPAC name is 2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole.

Molecular Properties

Compound Name2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole
PubChem CID3732902
Molecular FormulaC30H24Cl2N2O2
Molecular Weight515.44 g/mol
Exact Mass514.12
IUPAC Name2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole
SMILESCOc1ccc(Cn2c(-c3ccc(Cl)cc3)nc(-c3ccc(OC)cc3)c2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C30H24Cl2N2O2/c1-35-26-15-3-20(4-16-26)19-34-29(22-5-11-24(31)12-6-22)28(21-9-17-27(36-2)18-10-21)33-30(34)23-7-13-25(32)14-8-23/h3-18H,19H2,1-2H3
InChIKeyWBNJXEPZHPCEND-UHFFFAOYSA-N
XLogP8.26
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500515.44
LogP ≤ 58.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-phenyl-5-[[2,4,5-tris(4-methoxyphenyl)imidazol-1-yl]methyl]benzoic acid
CID 174813442
1-[(3,4-dimethoxyphenyl)methyl]-2,4,5-triphenylimidazole
CID 134953177
4-[[2-[3,5-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxyphenyl)imidazol-1-yl]methyl]-N'-hydroxybenzenecarboximidamide
CID 142732325
4-[[2-[3,5-bis(trifluoromethyl)phenyl]-4,5-bis(4-methoxyphenyl)imidazol-1-yl]methyl]-N-methylbenzamide
CID 122436652
5,6-dichloro-2-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]benzimidazole
CID 163409698
1-benzyl-2-(4-iodophenyl)-4,5-diphenylimidazole
CID 139218774
1-[(4-chlorophenyl)methyl]-2-(3,5-dimethoxyphenyl)benzimidazole
CID 20930586
1-chloro-4-(4-methoxyphenyl)benzene
CID 612791
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-4-[[4,5-bis(4-chlorophenyl)-2-(3,4,5-trimethoxyphenyl)imidazol-1-yl]methyl]benzamide
CID 122436616
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-4-[[4,5-bis(4-methoxyphenyl)-2-pyridin-3-ylimidazol-1-yl]methyl]benzamide
CID 122436657
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-4-[[2-(3,5-dicyanophenyl)-4,5-bis(4-methoxyphenyl)imidazol-1-yl]methyl]benzamide
CID 122436734
3-chloro-4-[(4-methoxyphenyl)methyl]-5-phenyl-1,2,4-triazole
CID 63383428

Frequently Asked Questions

What is the IUPAC name of 2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole?
The IUPAC name of 2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole (CID 3732902) is 2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole.
What is the SMILES notation for 2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole?
The canonical SMILES for 2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole is COc1ccc(Cn2c(-c3ccc(Cl)cc3)nc(-c3ccc(OC)cc3)c2-c2ccc(Cl)cc2)cc1.
What is the InChIKey of 2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole?
The InChIKey is WBNJXEPZHPCEND-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H24Cl2N2O2/c1-35-26-15-3-20(4-16-26)19-34-29(22-5-11-24(31)12-6-22)28(21-9-17-27(36-2)18-10-21)33-30(34)23-7-13-25(32)14-8-23/h3-18H,19H2,1-2H3.
What are the key properties of 2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole?
2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole has a molecular weight of 515.44 g/mol, XLogP of 8.26, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(4-chlorophenyl)-4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole is sourced from PubChem (CID 3732902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).