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

C16H11Cl3N2 — CID 53262807

IUPAC1-[(4-chlorophenyl)-(2,4-dichlorophenyl)methyl]imidazole
SMILESClc1ccc(C(c2ccc(Cl)cc2Cl)n2ccnc2)cc1
InChIInChI=1S/C16H11Cl3N2/c17-12-3-1-11(2-4-12)16(21-8-7-20-10-21)14-6-5-13(18)9-15(14)19/h1-10,16H
InChIKeyOJJJMXBVLDBHCG-UHFFFAOYSA-N
MW337.64 g/mol
LogP5.48
Rot. Bonds3

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

1-[(4-chlorophenyl)-(2,4-dichlorophenyl)methyl]imidazole (PubChem CID 53262807) has the molecular formula C16H11Cl3N2 and a molecular weight of 337.64 g/mol. Its IUPAC name is 1-[(4-chlorophenyl)-(2,4-dichlorophenyl)methyl]imidazole.

Molecular Properties

Compound Name1-[(4-chlorophenyl)-(2,4-dichlorophenyl)methyl]imidazole
PubChem CID53262807
Molecular FormulaC16H11Cl3N2
Molecular Weight337.64 g/mol
Exact Mass336.00
IUPAC Name1-[(4-chlorophenyl)-(2,4-dichlorophenyl)methyl]imidazole
SMILESClc1ccc(C(c2ccc(Cl)cc2Cl)n2ccnc2)cc1
InChIInChI=1S/C16H11Cl3N2/c17-12-3-1-11(2-4-12)16(21-8-7-20-10-21)14-6-5-13(18)9-15(14)19/h1-10,16H
InChIKeyOJJJMXBVLDBHCG-UHFFFAOYSA-N
XLogP5.48
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.64
LogP ≤ 55.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[(4-chlorophenyl)-(2,4-dichlorophenyl)methyl]imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[(2,4-dichlorophenyl)-imidazol-1-ylmethyl]-3-methyl-1,3-benzoxazol-2-one
CID 42600489
1-[cyclohexa-1,3-dien-1-yl-(2,4-dichlorophenyl)methyl]imidazole
CID 163657718
1-[(1R)-1-(2,4-dichlorophenyl)-2-[(2R)-2-(2,4-dichlorophenyl)-2-imidazol-1-ylethoxy]ethyl]imidazole
CID 166732164
1-[1-(2,4-dichlorophenyl)-2-[2-(2,4-dichlorophenyl)-2-imidazol-1-ylethoxy]ethyl]imidazole
CID 139707946
1-[(R)-(4-chlorophenyl)-(4-pyrrol-1-ylphenyl)methyl]imidazole
CID 57395780
1-[[4-(4-chloro-2-pyrrol-1-ylphenyl)-1H-pyrrol-3-yl]-(2,4-dichlorophenyl)methyl]imidazole
CID 155515175
1-[(2,4-dichlorophenyl)-(4-naphthalen-2-yl-1H-pyrrol-3-yl)methyl]imidazole
CID 155544140
1-[(2,4-dichlorophenyl)-[4-(4-methylsulfanylphenyl)-1H-pyrrol-3-yl]methyl]imidazole
CID 6481293
1-[(2,4-dichlorophenyl)-[4-(4-methoxyphenyl)-1H-pyrrol-3-yl]methyl]imidazole
CID 155561094
5-(2-chlorophenyl)-1-(2,4-dichlorophenyl)-4-[imidazol-1-yl(phenyl)methyl]pyrazole
CID 3012923
1-[(2-chlorophenyl)-(5,6,7,8-tetrachloro-5,6,7,8-tetrahydronaphthalen-2-yl)methyl]imidazole
CID 57320114
3-(2,4-dichlorophenyl)-2-imidazol-1-ylbutanethioic S-acid
CID 88521711

Frequently Asked Questions

What is the IUPAC name of 1-[(4-chlorophenyl)-(2,4-dichlorophenyl)methyl]imidazole?
The IUPAC name of 1-[(4-chlorophenyl)-(2,4-dichlorophenyl)methyl]imidazole (CID 53262807) is 1-[(4-chlorophenyl)-(2,4-dichlorophenyl)methyl]imidazole.
What is the SMILES notation for 1-[(4-chlorophenyl)-(2,4-dichlorophenyl)methyl]imidazole?
The canonical SMILES for 1-[(4-chlorophenyl)-(2,4-dichlorophenyl)methyl]imidazole is Clc1ccc(C(c2ccc(Cl)cc2Cl)n2ccnc2)cc1.
What is the InChIKey of 1-[(4-chlorophenyl)-(2,4-dichlorophenyl)methyl]imidazole?
The InChIKey is OJJJMXBVLDBHCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11Cl3N2/c17-12-3-1-11(2-4-12)16(21-8-7-20-10-21)14-6-5-13(18)9-15(14)19/h1-10,16H.
What are the key properties of 1-[(4-chlorophenyl)-(2,4-dichlorophenyl)methyl]imidazole?
1-[(4-chlorophenyl)-(2,4-dichlorophenyl)methyl]imidazole has a molecular weight of 337.64 g/mol, XLogP of 5.48, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-chlorophenyl)-(2,4-dichlorophenyl)methyl]imidazole is sourced from PubChem (CID 53262807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).