11-imidazo[1,2-f]phenanthridin-11-yloxy-2,3-dimethylimidazo[1,2-f]phenanthridine

C32H22N4O — CID 163873412

About 11-imidazo[1,2-f]phenanthridin-11-yloxy-2,3-dimethylimidazo[1,2-f]phenanthridine

11-imidazo[1,2-f]phenanthridin-11-yloxy-2,3-dimethylimidazo[1,2-f]phenanthridine (PubChem CID 163873412) has the molecular formula C32H22N4O and a molecular weight of 478.56 g/mol. Its IUPAC name is 11-imidazo[1,2-f]phenanthridin-11-yloxy-2,3-dimethylimidazo[1,2-f]phenanthridine.

Molecular Properties

• Compound Name: 11-imidazo[1,2-f]phenanthridin-11-yloxy-2,3-dimethylimidazo[1,2-f]phenanthridine
• PubChem CID: 163873412
• Molecular Formula: C32H22N4O
• Molecular Weight: 478.56 g/mol
• Exact Mass: 478.18
• IUPAC Name: 11-imidazo[1,2-f]phenanthridin-11-yloxy-2,3-dimethylimidazo[1,2-f]phenanthridine
• SMILES: Cc1nc2c3cc(Oc4ccc5c6ccccc6n6ccnc6c5c4)ccc3c3ccccc3n2c1C
• InChI: InChI=1S/C32H22N4O/c1-19-20(2)36-30-10-6-4-8-26(30)24-14-12-22(18-28(24)32(36)34-19)37-21-11-13-23-25-7-3-5-9-29(25)35-16-15-33-31(35)27(23)17-21/h3-18H,1-2H3
• InChIKey: LYJLNFCFZLCMAS-UHFFFAOYSA-N
• XLogP: 8.00
• TPSA: 43.83 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 2
• Heavy Atoms: 37
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	478.56
LogP ≤ 5	8.00
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 11-imidazo[1,2-f]phenanthridin-11-yloxy-2,3-dimethylimidazo[1,2-f]phenanthridine?

The IUPAC name of 11-imidazo[1,2-f]phenanthridin-11-yloxy-2,3-dimethylimidazo[1,2-f]phenanthridine (CID 163873412) is 11-imidazo[1,2-f]phenanthridin-11-yloxy-2,3-dimethylimidazo[1,2-f]phenanthridine.

What is the SMILES notation for 11-imidazo[1,2-f]phenanthridin-11-yloxy-2,3-dimethylimidazo[1,2-f]phenanthridine?

The canonical SMILES for 11-imidazo[1,2-f]phenanthridin-11-yloxy-2,3-dimethylimidazo[1,2-f]phenanthridine is Cc1nc2c3cc(Oc4ccc5c6ccccc6n6ccnc6c5c4)ccc3c3ccccc3n2c1C.

What is the InChIKey of 11-imidazo[1,2-f]phenanthridin-11-yloxy-2,3-dimethylimidazo[1,2-f]phenanthridine?

The InChIKey is LYJLNFCFZLCMAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H22N4O/c1-19-20(2)36-30-10-6-4-8-26(30)24-14-12-22(18-28(24)32(36)34-19)37-21-11-13-23-25-7-3-5-9-29(25)35-16-15-33-31(35)27(23)17-21/h3-18H,1-2H3.

What are the key properties of 11-imidazo[1,2-f]phenanthridin-11-yloxy-2,3-dimethylimidazo[1,2-f]phenanthridine?

11-imidazo[1,2-f]phenanthridin-11-yloxy-2,3-dimethylimidazo[1,2-f]phenanthridine has a molecular weight of 478.56 g/mol, XLogP of 8.00, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 11-imidazo[1,2-f]phenanthridin-11-yloxy-2,3-dimethylimidazo[1,2-f]phenanthridine is sourced from PubChem (CID 163873412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).