4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide

C26H19N3O — CID 21449966

IUPAC4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide
SMILESO=C(Nc1nc2c(-c3ccccc3)cccc2[nH]1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C26H19N3O/c30-25(21-16-14-19(15-17-21)18-8-3-1-4-9-18)29-26-27-23-13-7-12-22(24(23)28-26)20-10-5-2-6-11-20/h1-17H,(H2,27,28,29,30)
InChIKeyOWVXIASVQRSEEI-UHFFFAOYSA-N
MW389.46 g/mol
LogP6.15
Rot. Bonds4

About 4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide

4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide (PubChem CID 21449966) has the molecular formula C26H19N3O and a molecular weight of 389.46 g/mol. Its IUPAC name is 4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide.

Molecular Properties

Compound Name4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide
PubChem CID21449966
Molecular FormulaC26H19N3O
Molecular Weight389.46 g/mol
Exact Mass389.15
IUPAC Name4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide
SMILESO=C(Nc1nc2c(-c3ccccc3)cccc2[nH]1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C26H19N3O/c30-25(21-16-14-19(15-17-21)18-8-3-1-4-9-18)29-26-27-23-13-7-12-22(24(23)28-26)20-10-5-2-6-11-20/h1-17H,(H2,27,28,29,30)
InChIKeyOWVXIASVQRSEEI-UHFFFAOYSA-N
XLogP6.15
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.46
LogP ≤ 56.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide?
The IUPAC name of 4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide (CID 21449966) is 4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide.
What is the SMILES notation for 4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide?
The canonical SMILES for 4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide is O=C(Nc1nc2c(-c3ccccc3)cccc2[nH]1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide?
The InChIKey is OWVXIASVQRSEEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19N3O/c30-25(21-16-14-19(15-17-21)18-8-3-1-4-9-18)29-26-27-23-13-7-12-22(24(23)28-26)20-10-5-2-6-11-20/h1-17H,(H2,27,28,29,30).
What are the key properties of 4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide?
4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide has a molecular weight of 389.46 g/mol, XLogP of 6.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-(4-phenyl-1H-benzimidazol-2-yl)benzamide is sourced from PubChem (CID 21449966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).