10-[2-[3-[2-(2,3-dimethylimidazo[1,2-f]phenanthridin-10-yl)phenyl]-5-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylphenyl]phenyl]phenyl]phenyl]-2,3-dimethylimidazo[1,2-f]phenanthridine

C81H57N5 — CID 153458073

About 10-[2-[3-[2-(2,3-dimethylimidazo[1,2-f]phenanthridin-10-yl)phenyl]-5-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylphenyl]phenyl]phenyl]phenyl]-2,3-dimethylimidazo[1,2-f]phenanthridine

10-[2-[3-[2-(2,3-dimethylimidazo[1,2-f]phenanthridin-10-yl)phenyl]-5-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylphenyl]phenyl]phenyl]phenyl]-2,3-dimethylimidazo[1,2-f]phenanthridine (PubChem CID 153458073) has the molecular formula C81H57N5 and a molecular weight of 1100.38 g/mol. Its IUPAC name is 10-[2-[3-[2-(2,3-dimethylimidazo[1,2-f]phenanthridin-10-yl)phenyl]-5-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylphenyl]phenyl]phenyl]phenyl]-2,3-dimethylimidazo[1,2-f]phenanthridine.

Molecular Properties

• Compound Name: 10-[2-[3-[2-(2,3-dimethylimidazo[1,2-f]phenanthridin-10-yl)phenyl]-5-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylphenyl]phenyl]phenyl]phenyl]-2,3-dimethylimidazo[1,2-f]phenanthridine
• PubChem CID: 153458073
• Molecular Formula: C81H57N5
• Molecular Weight: 1100.38 g/mol
• Exact Mass: 1099.46
• IUPAC Name: 10-[2-[3-[2-(2,3-dimethylimidazo[1,2-f]phenanthridin-10-yl)phenyl]-5-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylphenyl]phenyl]phenyl]phenyl]-2,3-dimethylimidazo[1,2-f]phenanthridine
• SMILES: Cc1nc2c3ccc(-c4ccccc4-c4cc(-c5ccccc5-c5ccc6c(c5)c5ccccc5n5c(C)c(C)nc65)cc(-c5ccccc5-c5ccc(-c6ccccn6)cc5-c5ccc(-c6ccccc6)cc5)c4)cc3c3ccccc3n2c1C
• InChI: InChI=1S/C81H57N5/c1-50-52(3)85-78-31-16-14-28-70(78)75-47-57(37-41-72(75)80(85)83-50)63-22-8-10-24-65(63)60-44-61(66-25-11-9-23-64(66)58-38-42-73-76(48-58)71-29-15-17-32-79(71)86-53(4)51(2)84-81(73)86)46-62(45-60)67-26-12-13-27-68(67)69-40-39-59(77-30-18-19-43-82-77)49-74(69)56-35-33-55(34-36-56)54-20-6-5-7-21-54/h5-49H,1-4H3
• InChIKey: YHNBQEQLLANLKO-UHFFFAOYSA-N
• XLogP: 21.23
• TPSA: 47.49 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 9
• Heavy Atoms: 86
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1100.38
LogP ≤ 5	21.23
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 10-[2-[3-[2-(2,3-dimethylimidazo[1,2-f]phenanthridin-10-yl)phenyl]-5-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylphenyl]phenyl]phenyl]phenyl]-2,3-dimethylimidazo[1,2-f]phenanthridine?

The IUPAC name of 10-[2-[3-[2-(2,3-dimethylimidazo[1,2-f]phenanthridin-10-yl)phenyl]-5-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylphenyl]phenyl]phenyl]phenyl]-2,3-dimethylimidazo[1,2-f]phenanthridine (CID 153458073) is 10-[2-[3-[2-(2,3-dimethylimidazo[1,2-f]phenanthridin-10-yl)phenyl]-5-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylphenyl]phenyl]phenyl]phenyl]-2,3-dimethylimidazo[1,2-f]phenanthridine.

What is the SMILES notation for 10-[2-[3-[2-(2,3-dimethylimidazo[1,2-f]phenanthridin-10-yl)phenyl]-5-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylphenyl]phenyl]phenyl]phenyl]-2,3-dimethylimidazo[1,2-f]phenanthridine?

The canonical SMILES for 10-[2-[3-[2-(2,3-dimethylimidazo[1,2-f]phenanthridin-10-yl)phenyl]-5-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylphenyl]phenyl]phenyl]phenyl]-2,3-dimethylimidazo[1,2-f]phenanthridine is Cc1nc2c3ccc(-c4ccccc4-c4cc(-c5ccccc5-c5ccc6c(c5)c5ccccc5n5c(C)c(C)nc65)cc(-c5ccccc5-c5ccc(-c6ccccn6)cc5-c5ccc(-c6ccccc6)cc5)c4)cc3c3ccccc3n2c1C.

What is the InChIKey of 10-[2-[3-[2-(2,3-dimethylimidazo[1,2-f]phenanthridin-10-yl)phenyl]-5-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylphenyl]phenyl]phenyl]phenyl]-2,3-dimethylimidazo[1,2-f]phenanthridine?

The InChIKey is YHNBQEQLLANLKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C81H57N5/c1-50-52(3)85-78-31-16-14-28-70(78)75-47-57(37-41-72(75)80(85)83-50)63-22-8-10-24-65(63)60-44-61(66-25-11-9-23-64(66)58-38-42-73-76(48-58)71-29-15-17-32-79(71)86-53(4)51(2)84-81(73)86)46-62(45-60)67-26-12-13-27-68(67)69-40-39-59(77-30-18-19-43-82-77)49-74(69)56-35-33-55(34-36-56)54-20-6-5-7-21-54/h5-49H,1-4H3.

What are the key properties of 10-[2-[3-[2-(2,3-dimethylimidazo[1,2-f]phenanthridin-10-yl)phenyl]-5-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylphenyl]phenyl]phenyl]phenyl]-2,3-dimethylimidazo[1,2-f]phenanthridine?

10-[2-[3-[2-(2,3-dimethylimidazo[1,2-f]phenanthridin-10-yl)phenyl]-5-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylphenyl]phenyl]phenyl]phenyl]-2,3-dimethylimidazo[1,2-f]phenanthridine has a molecular weight of 1100.38 g/mol, XLogP of 21.23, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 10-[2-[3-[2-(2,3-dimethylimidazo[1,2-f]phenanthridin-10-yl)phenyl]-5-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylphenyl]phenyl]phenyl]phenyl]-2,3-dimethylimidazo[1,2-f]phenanthridine is sourced from PubChem (CID 153458073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).