1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole

C22H17ClN2 — CID 19902800

IUPAC1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole
SMILESCc1nc(-c2ccccc2)c(-c2ccccc2)n1-c1ccccc1Cl
InChIInChI=1S/C22H17ClN2/c1-16-24-21(17-10-4-2-5-11-17)22(18-12-6-3-7-13-18)25(16)20-15-9-8-14-19(20)23/h2-15H,1H3
InChIKeyMZUDOTBJIGNWKA-UHFFFAOYSA-N
MW344.85 g/mol
LogP6.17
Rot. Bonds3

About 1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole

1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole (PubChem CID 19902800) has the molecular formula C22H17ClN2 and a molecular weight of 344.85 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole.

Molecular Properties

Compound Name1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole
PubChem CID19902800
Molecular FormulaC22H17ClN2
Molecular Weight344.85 g/mol
Exact Mass344.11
IUPAC Name1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole
SMILESCc1nc(-c2ccccc2)c(-c2ccccc2)n1-c1ccccc1Cl
InChIInChI=1S/C22H17ClN2/c1-16-24-21(17-10-4-2-5-11-17)22(18-12-6-3-7-13-18)25(16)20-15-9-8-14-19(20)23/h2-15H,1H3
InChIKeyMZUDOTBJIGNWKA-UHFFFAOYSA-N
XLogP6.17
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.85
LogP ≤ 56.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole?
The IUPAC name of 1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole (CID 19902800) is 1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole.
What is the SMILES notation for 1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole?
The canonical SMILES for 1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole is Cc1nc(-c2ccccc2)c(-c2ccccc2)n1-c1ccccc1Cl.
What is the InChIKey of 1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole?
The InChIKey is MZUDOTBJIGNWKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17ClN2/c1-16-24-21(17-10-4-2-5-11-17)22(18-12-6-3-7-13-18)25(16)20-15-9-8-14-19(20)23/h2-15H,1H3.
What are the key properties of 1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole?
1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole has a molecular weight of 344.85 g/mol, XLogP of 6.17, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-2-methyl-4,5-diphenylimidazole is sourced from PubChem (CID 19902800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).