2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole

C22H20N2O2 — CID 73265446

IUPAC2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole
SMILESCOc1cccc(Cn2c(-c3cccc(OC)c3)nc3ccccc32)c1
InChIInChI=1S/C22H20N2O2/c1-25-18-9-5-7-16(13-18)15-24-21-12-4-3-11-20(21)23-22(24)17-8-6-10-19(14-17)26-2/h3-14H,15H2,1-2H3
InChIKeyLUUBMJOANXDSBK-UHFFFAOYSA-N
MW344.41 g/mol
LogP4.77
Rot. Bonds5

About 2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole

2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole (PubChem CID 73265446) has the molecular formula C22H20N2O2 and a molecular weight of 344.41 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole
PubChem CID73265446
Molecular FormulaC22H20N2O2
Molecular Weight344.41 g/mol
Exact Mass344.15
IUPAC Name2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole
SMILESCOc1cccc(Cn2c(-c3cccc(OC)c3)nc3ccccc32)c1
InChIInChI=1S/C22H20N2O2/c1-25-18-9-5-7-16(13-18)15-24-21-12-4-3-11-20(21)23-22(24)17-8-6-10-19(14-17)26-2/h3-14H,15H2,1-2H3
InChIKeyLUUBMJOANXDSBK-UHFFFAOYSA-N
XLogP4.77
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole?
The IUPAC name of 2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole (CID 73265446) is 2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole.
What is the SMILES notation for 2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole?
The canonical SMILES for 2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole is COc1cccc(Cn2c(-c3cccc(OC)c3)nc3ccccc32)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole?
The InChIKey is LUUBMJOANXDSBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O2/c1-25-18-9-5-7-16(13-18)15-24-21-12-4-3-11-20(21)23-22(24)17-8-6-10-19(14-17)26-2/h3-14H,15H2,1-2H3.
What are the key properties of 2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole?
2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole has a molecular weight of 344.41 g/mol, XLogP of 4.77, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]benzimidazole is sourced from PubChem (CID 73265446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).