platinum(2+);1-N-pyridin-2-yl-3-N-(3-pyridin-2-ylbenzene-2-id-1-yl)isoindol-2-ide-1,3-diimine

C24H15N5Pt — CID 161402132

About platinum(2+);1-N-pyridin-2-yl-3-N-(3-pyridin-2-ylbenzene-2-id-1-yl)isoindol-2-ide-1,3-diimine

platinum(2+);1-N-pyridin-2-yl-3-N-(3-pyridin-2-ylbenzene-2-id-1-yl)isoindol-2-ide-1,3-diimine (PubChem CID 161402132) has the molecular formula C24H15N5Pt and a molecular weight of 568.50 g/mol. Its IUPAC name is platinum(2+);1-N-pyridin-2-yl-3-N-(3-pyridin-2-ylbenzene-2-id-1-yl)isoindol-2-ide-1,3-diimine.

Molecular Properties

• Compound Name: platinum(2+);1-N-pyridin-2-yl-3-N-(3-pyridin-2-ylbenzene-2-id-1-yl)isoindol-2-ide-1,3-diimine
• PubChem CID: 161402132
• Molecular Formula: C24H15N5Pt
• Molecular Weight: 568.50 g/mol
• Exact Mass: 568.10
• IUPAC Name: platinum(2+);1-N-pyridin-2-yl-3-N-(3-pyridin-2-ylbenzene-2-id-1-yl)isoindol-2-ide-1,3-diimine
• SMILES: [Pt+2].[c-]1c(/N=C2\[N-]C(=Nc3ccccn3)c3ccccc32)cccc1-c1ccccn1
• InChI: InChI=1S/C24H15N5.Pt/c1-2-11-20-19(10-1)23(29-24(20)28-22-13-4-6-15-26-22)27-18-9-7-8-17(16-18)21-12-3-5-14-25-21;/h1-15H;/q-2;+2
• InChIKey: VANZYWPEMWEDLA-UHFFFAOYSA-N
• XLogP: 5.49
• TPSA: 64.60 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 3
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	568.50
LogP ≤ 5	5.49
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of platinum(2+);1-N-pyridin-2-yl-3-N-(3-pyridin-2-ylbenzene-2-id-1-yl)isoindol-2-ide-1,3-diimine?

The IUPAC name of platinum(2+);1-N-pyridin-2-yl-3-N-(3-pyridin-2-ylbenzene-2-id-1-yl)isoindol-2-ide-1,3-diimine (CID 161402132) is platinum(2+);1-N-pyridin-2-yl-3-N-(3-pyridin-2-ylbenzene-2-id-1-yl)isoindol-2-ide-1,3-diimine.

What is the SMILES notation for platinum(2+);1-N-pyridin-2-yl-3-N-(3-pyridin-2-ylbenzene-2-id-1-yl)isoindol-2-ide-1,3-diimine?

The canonical SMILES for platinum(2+);1-N-pyridin-2-yl-3-N-(3-pyridin-2-ylbenzene-2-id-1-yl)isoindol-2-ide-1,3-diimine is [Pt+2].[c-]1c(/N=C2\[N-]C(=Nc3ccccn3)c3ccccc32)cccc1-c1ccccn1.

What is the InChIKey of platinum(2+);1-N-pyridin-2-yl-3-N-(3-pyridin-2-ylbenzene-2-id-1-yl)isoindol-2-ide-1,3-diimine?

The InChIKey is VANZYWPEMWEDLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15N5.Pt/c1-2-11-20-19(10-1)23(29-24(20)28-22-13-4-6-15-26-22)27-18-9-7-8-17(16-18)21-12-3-5-14-25-21;/h1-15H;/q-2;+2.

What are the key properties of platinum(2+);1-N-pyridin-2-yl-3-N-(3-pyridin-2-ylbenzene-2-id-1-yl)isoindol-2-ide-1,3-diimine?

platinum(2+);1-N-pyridin-2-yl-3-N-(3-pyridin-2-ylbenzene-2-id-1-yl)isoindol-2-ide-1,3-diimine has a molecular weight of 568.50 g/mol, XLogP of 5.49, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for platinum(2+);1-N-pyridin-2-yl-3-N-(3-pyridin-2-ylbenzene-2-id-1-yl)isoindol-2-ide-1,3-diimine is sourced from PubChem (CID 161402132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).