6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole

C56H37N5OSi — CID 140955680

About 6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole

6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole (PubChem CID 140955680) has the molecular formula C56H37N5OSi and a molecular weight of 824.03 g/mol. Its IUPAC name is 6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole.

Molecular Properties

• Compound Name: 6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole
• PubChem CID: 140955680
• Molecular Formula: C56H37N5OSi
• Molecular Weight: 824.03 g/mol
• Exact Mass: 823.28
• IUPAC Name: 6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole
• SMILES: c1ccc(N2c3ccccc3[Si](c3ccccc3)(c3ccccc3)c3c2c(Oc2ccc4c5ccccc5n5ccnc5c4c2)cc2c3c3ccccc3n2-c2ccccn2)cc1
• InChI: InChI=1S/C56H37N5OSi/c1-4-18-38(19-5-1)60-48-28-14-15-29-51(48)63(40-20-6-2-7-21-40,41-22-8-3-9-23-41)55-53-44-25-11-13-27-47(44)61(52-30-16-17-33-57-52)49(53)37-50(54(55)60)62-39-31-32-42-43-24-10-12-26-46(43)59-35-34-58-56(59)45(42)36-39/h1-37H
• InChIKey: MHDIHHDHJTVMSX-UHFFFAOYSA-N
• XLogP: 11.09
• TPSA: 47.59 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 63
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	824.03
LogP ≤ 5	11.09
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole?

The IUPAC name of 6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole (CID 140955680) is 6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole.

What is the SMILES notation for 6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole?

The canonical SMILES for 6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole is c1ccc(N2c3ccccc3[Si](c3ccccc3)(c3ccccc3)c3c2c(Oc2ccc4c5ccccc5n5ccnc5c4c2)cc2c3c3ccccc3n2-c2ccccn2)cc1.

What is the InChIKey of 6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole?

The InChIKey is MHDIHHDHJTVMSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H37N5OSi/c1-4-18-38(19-5-1)60-48-28-14-15-29-51(48)63(40-20-6-2-7-21-40,41-22-8-3-9-23-41)55-53-44-25-11-13-27-47(44)61(52-30-16-17-33-57-52)49(53)37-50(54(55)60)62-39-31-32-42-43-24-10-12-26-46(43)59-35-34-58-56(59)45(42)36-39/h1-37H.

What are the key properties of 6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole?

6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole has a molecular weight of 824.03 g/mol, XLogP of 11.09, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole is sourced from PubChem (CID 140955680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).