3-pyridin-2-yl-1-[(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylmethylselanyl]imidazo[1,5-a]pyridine

C25H18N6Se2 — CID 102300548

About 3-pyridin-2-yl-1-[(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylmethylselanyl]imidazo[1,5-a]pyridine

3-pyridin-2-yl-1-[(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylmethylselanyl]imidazo[1,5-a]pyridine (PubChem CID 102300548) has the molecular formula C25H18N6Se2 and a molecular weight of 560.38 g/mol. Its IUPAC name is 3-pyridin-2-yl-1-[(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylmethylselanyl]imidazo[1,5-a]pyridine.

Molecular Properties

• Compound Name: 3-pyridin-2-yl-1-[(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylmethylselanyl]imidazo[1,5-a]pyridine
• PubChem CID: 102300548
• Molecular Formula: C25H18N6Se2
• Molecular Weight: 560.38 g/mol
• Exact Mass: 561.99
• IUPAC Name: 3-pyridin-2-yl-1-[(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylmethylselanyl]imidazo[1,5-a]pyridine
• SMILES: c1ccc(-c2nc([Se]C[Se]c3nc(-c4ccccn4)n4ccccc34)c3ccccn23)nc1
• InChI: InChI=1S/C25H18N6Se2/c1-5-13-26-18(9-1)22-28-24(20-11-3-7-15-30(20)22)32-17-33-25-21-12-4-8-16-31(21)23(29-25)19-10-2-6-14-27-19/h1-16H,17H2
• InChIKey: UIHYBLQGIDPERN-UHFFFAOYSA-N
• XLogP: 2.84
• TPSA: 60.38 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	560.38
LogP ≤ 5	2.84
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-pyridin-2-yl-1-[(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylmethylselanyl]imidazo[1,5-a]pyridine?

The IUPAC name of 3-pyridin-2-yl-1-[(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylmethylselanyl]imidazo[1,5-a]pyridine (CID 102300548) is 3-pyridin-2-yl-1-[(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylmethylselanyl]imidazo[1,5-a]pyridine.

What is the SMILES notation for 3-pyridin-2-yl-1-[(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylmethylselanyl]imidazo[1,5-a]pyridine?

The canonical SMILES for 3-pyridin-2-yl-1-[(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylmethylselanyl]imidazo[1,5-a]pyridine is c1ccc(-c2nc([Se]C[Se]c3nc(-c4ccccn4)n4ccccc34)c3ccccn23)nc1.

What is the InChIKey of 3-pyridin-2-yl-1-[(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylmethylselanyl]imidazo[1,5-a]pyridine?

The InChIKey is UIHYBLQGIDPERN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18N6Se2/c1-5-13-26-18(9-1)22-28-24(20-11-3-7-15-30(20)22)32-17-33-25-21-12-4-8-16-31(21)23(29-25)19-10-2-6-14-27-19/h1-16H,17H2.

What are the key properties of 3-pyridin-2-yl-1-[(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylmethylselanyl]imidazo[1,5-a]pyridine?

3-pyridin-2-yl-1-[(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylmethylselanyl]imidazo[1,5-a]pyridine has a molecular weight of 560.38 g/mol, XLogP of 2.84, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-pyridin-2-yl-1-[(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylmethylselanyl]imidazo[1,5-a]pyridine is sourced from PubChem (CID 102300548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).