4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine

C63H43N9 — CID 158535696

About 4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine

4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine (PubChem CID 158535696) has the molecular formula C63H43N9 and a molecular weight of 926.10 g/mol. Its IUPAC name is 4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine.

Molecular Properties

• Compound Name: 4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine
• PubChem CID: 158535696
• Molecular Formula: C63H43N9
• Molecular Weight: 926.10 g/mol
• Exact Mass: 925.36
• IUPAC Name: 4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine
• SMILES: c1ccc(-c2cc(-c3ccccn3)nc(-c3cccc(-c4cc(-c5ccccc5)cc(-c5ccccn5)n4)n3)c2)cc1.c1ccc(-c2cccc(-c3ccc(-c4cccc(-c5ccccn5)n4)cc3)n2)nc1
• InChI: InChI=1S/C37H25N5.C26H18N4/c1-3-12-26(13-4-1)28-22-34(30-16-7-9-20-38-30)41-36(24-28)32-18-11-19-33(40-32)37-25-29(27-14-5-2-6-15-27)23-35(42-37)31-17-8-10-21-39-31;1-3-17-27-23(7-1)25-11-5-9-21(29-25)19-13-15-20(16-14-19)22-10-6-12-26(30-22)24-8-2-4-18-28-24/h1-25H;1-18H
• InChIKey: HNXNDIVCWWGOLQ-UHFFFAOYSA-N
• XLogP: 14.60
• TPSA: 116.01 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 10
• Heavy Atoms: 72
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	926.10
LogP ≤ 5	14.60
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine?

The IUPAC name of 4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine (CID 158535696) is 4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine.

What is the SMILES notation for 4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine?

The canonical SMILES for 4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine is c1ccc(-c2cc(-c3ccccn3)nc(-c3cccc(-c4cc(-c5ccccc5)cc(-c5ccccn5)n4)n3)c2)cc1.c1ccc(-c2cccc(-c3ccc(-c4cccc(-c5ccccn5)n4)cc3)n2)nc1.

What is the InChIKey of 4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine?

The InChIKey is HNXNDIVCWWGOLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H25N5.C26H18N4/c1-3-12-26(13-4-1)28-22-34(30-16-7-9-20-38-30)41-36(24-28)32-18-11-19-33(40-32)37-25-29(27-14-5-2-6-15-27)23-35(42-37)31-17-8-10-21-39-31;1-3-17-27-23(7-1)25-11-5-9-21(29-25)19-13-15-20(16-14-19)22-10-6-12-26(30-22)24-8-2-4-18-28-24/h1-25H;1-18H.

What are the key properties of 4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine?

4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine has a molecular weight of 926.10 g/mol, XLogP of 14.60, 10 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine is sourced from PubChem (CID 158535696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).