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

C24H16N6Se — CID 101358932

IUPAC3-pyridin-2-yl-1-(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylimidazo[1,5-a]pyridine
SMILESc1ccc(-c2nc([Se]c3nc(-c4ccccn4)n4ccccc34)c3ccccn23)nc1
InChIInChI=1S/C24H16N6Se/c1-5-13-25-17(9-1)21-27-23(19-11-3-7-15-29(19)21)31-24-20-12-4-8-16-30(20)22(28-24)18-10-2-6-14-26-18/h1-16H
InChIKeyLXHTWXCJNBZSQG-UHFFFAOYSA-N
MW467.39 g/mol
LogP2.76
Rot. Bonds4

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

3-pyridin-2-yl-1-(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylimidazo[1,5-a]pyridine (PubChem CID 101358932) has the molecular formula C24H16N6Se and a molecular weight of 467.39 g/mol. Its IUPAC name is 3-pyridin-2-yl-1-(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3-pyridin-2-yl-1-(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylimidazo[1,5-a]pyridine
PubChem CID101358932
Molecular FormulaC24H16N6Se
Molecular Weight467.39 g/mol
Exact Mass468.06
IUPAC Name3-pyridin-2-yl-1-(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylimidazo[1,5-a]pyridine
SMILESc1ccc(-c2nc([Se]c3nc(-c4ccccn4)n4ccccc34)c3ccccn23)nc1
InChIInChI=1S/C24H16N6Se/c1-5-13-25-17(9-1)21-27-23(19-11-3-7-15-29(19)21)31-24-20-12-4-8-16-30(20)22(28-24)18-10-2-6-14-26-18/h1-16H
InChIKeyLXHTWXCJNBZSQG-UHFFFAOYSA-N
XLogP2.76
TPSA60.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.39
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-pyridin-2-yl-1-(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylimidazo[1,5-a]pyridine?
The IUPAC name of 3-pyridin-2-yl-1-(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylimidazo[1,5-a]pyridine (CID 101358932) is 3-pyridin-2-yl-1-(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylimidazo[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)selanylimidazo[1,5-a]pyridine?
The canonical SMILES for 3-pyridin-2-yl-1-(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylimidazo[1,5-a]pyridine is c1ccc(-c2nc([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)selanylimidazo[1,5-a]pyridine?
The InChIKey is LXHTWXCJNBZSQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N6Se/c1-5-13-25-17(9-1)21-27-23(19-11-3-7-15-29(19)21)31-24-20-12-4-8-16-30(20)22(28-24)18-10-2-6-14-26-18/h1-16H.
What are the key properties of 3-pyridin-2-yl-1-(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylimidazo[1,5-a]pyridine?
3-pyridin-2-yl-1-(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)selanylimidazo[1,5-a]pyridine has a molecular weight of 467.39 g/mol, XLogP of 2.76, 4 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)selanylimidazo[1,5-a]pyridine is sourced from PubChem (CID 101358932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).