5-[2-[3-[2-(3-methyl-2-phenylimidazol-4-yl)phenyl]-5-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-phenylpyridine

C68H48N4 — CID 153458691

About 5-[2-[3-[2-(3-methyl-2-phenylimidazol-4-yl)phenyl]-5-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-phenylpyridine

5-[2-[3-[2-(3-methyl-2-phenylimidazol-4-yl)phenyl]-5-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-phenylpyridine (PubChem CID 153458691) has the molecular formula C68H48N4 and a molecular weight of 921.16 g/mol. Its IUPAC name is 5-[2-[3-[2-(3-methyl-2-phenylimidazol-4-yl)phenyl]-5-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-phenylpyridine.

Molecular Properties

• Compound Name: 5-[2-[3-[2-(3-methyl-2-phenylimidazol-4-yl)phenyl]-5-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-phenylpyridine
• PubChem CID: 153458691
• Molecular Formula: C68H48N4
• Molecular Weight: 921.16 g/mol
• Exact Mass: 920.39
• IUPAC Name: 5-[2-[3-[2-(3-methyl-2-phenylimidazol-4-yl)phenyl]-5-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-phenylpyridine
• SMILES: Cn1c(-c2ccccc2-c2cc(-c3ccccc3-c3ccc(-c4ccccc4)nc3)cc(-c3ccccc3-c3ccc(-c4cccc(-c5ccc(-c6ccccc6)cc5)c4)nc3)c2)cnc1-c1ccccc1
• InChI: InChI=1S/C68H48N4/c1-72-67(46-71-68(72)51-22-9-4-10-23-51)64-31-16-15-30-63(64)58-42-56(61-28-13-11-26-59(61)54-36-38-65(69-44-54)50-20-7-3-8-21-50)41-57(43-58)62-29-14-12-27-60(62)55-37-39-66(70-45-55)53-25-17-24-52(40-53)49-34-32-48(33-35-49)47-18-5-2-6-19-47/h2-46H,1H3
• InChIKey: ODTTWRCLURFVFL-UHFFFAOYSA-N
• XLogP: 17.55
• TPSA: 43.60 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 11
• Heavy Atoms: 72
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	921.16
LogP ≤ 5	17.55
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 5-[2-[3-[2-(3-methyl-2-phenylimidazol-4-yl)phenyl]-5-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-phenylpyridine?

The IUPAC name of 5-[2-[3-[2-(3-methyl-2-phenylimidazol-4-yl)phenyl]-5-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-phenylpyridine (CID 153458691) is 5-[2-[3-[2-(3-methyl-2-phenylimidazol-4-yl)phenyl]-5-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-phenylpyridine.

What is the SMILES notation for 5-[2-[3-[2-(3-methyl-2-phenylimidazol-4-yl)phenyl]-5-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-phenylpyridine?

The canonical SMILES for 5-[2-[3-[2-(3-methyl-2-phenylimidazol-4-yl)phenyl]-5-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-phenylpyridine is Cn1c(-c2ccccc2-c2cc(-c3ccccc3-c3ccc(-c4ccccc4)nc3)cc(-c3ccccc3-c3ccc(-c4cccc(-c5ccc(-c6ccccc6)cc5)c4)nc3)c2)cnc1-c1ccccc1.

What is the InChIKey of 5-[2-[3-[2-(3-methyl-2-phenylimidazol-4-yl)phenyl]-5-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-phenylpyridine?

The InChIKey is ODTTWRCLURFVFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H48N4/c1-72-67(46-71-68(72)51-22-9-4-10-23-51)64-31-16-15-30-63(64)58-42-56(61-28-13-11-26-59(61)54-36-38-65(69-44-54)50-20-7-3-8-21-50)41-57(43-58)62-29-14-12-27-60(62)55-37-39-66(70-45-55)53-25-17-24-52(40-53)49-34-32-48(33-35-49)47-18-5-2-6-19-47/h2-46H,1H3.

What are the key properties of 5-[2-[3-[2-(3-methyl-2-phenylimidazol-4-yl)phenyl]-5-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-phenylpyridine?

5-[2-[3-[2-(3-methyl-2-phenylimidazol-4-yl)phenyl]-5-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-phenylpyridine has a molecular weight of 921.16 g/mol, XLogP of 17.55, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[2-[3-[2-(3-methyl-2-phenylimidazol-4-yl)phenyl]-5-[2-[6-[3-(4-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-phenylpyridine is sourced from PubChem (CID 153458691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).