7-methyl-3-[6-[2-[6-(7-methyl-2H-imidazo[4,5-b]pyridin-2-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2H-imidazo[4,5-b]pyridin-2-ide;palladium(2+)

C27H22N8Pd — CID 58084518

About 7-methyl-3-[6-[2-[6-(7-methyl-2H-imidazo[4,5-b]pyridin-2-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2H-imidazo[4,5-b]pyridin-2-ide;palladium(2+)

7-methyl-3-[6-[2-[6-(7-methyl-2H-imidazo[4,5-b]pyridin-2-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2H-imidazo[4,5-b]pyridin-2-ide;palladium(2+) (PubChem CID 58084518) has the molecular formula C27H22N8Pd and a molecular weight of 564.95 g/mol. Its IUPAC name is 7-methyl-3-[6-[2-[6-(7-methyl-2H-imidazo[4,5-b]pyridin-2-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2H-imidazo[4,5-b]pyridin-2-ide;palladium(2+).

Molecular Properties

• Compound Name: 7-methyl-3-[6-[2-[6-(7-methyl-2H-imidazo[4,5-b]pyridin-2-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2H-imidazo[4,5-b]pyridin-2-ide;palladium(2+)
• PubChem CID: 58084518
• Molecular Formula: C27H22N8Pd
• Molecular Weight: 564.95 g/mol
• Exact Mass: 564.10
• IUPAC Name: 7-methyl-3-[6-[2-[6-(7-methyl-2H-imidazo[4,5-b]pyridin-2-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2H-imidazo[4,5-b]pyridin-2-ide;palladium(2+)
• SMILES: Cc1ccnc2c1n[c-]n2-c1cccc(C(C)(C)c2cccc(-n3[c-]nc4c(C)ccnc43)n2)n1.[Pd+2]
• InChI: InChI=1S/C27H22N8.Pd/c1-17-11-13-28-25-23(17)30-15-34(25)21-9-5-7-19(32-21)27(3,4)20-8-6-10-22(33-20)35-16-31-24-18(2)12-14-29-26(24)35;/h5-14H,1-4H3;/q-2;+2
• InChIKey: VVMFBKDTBRCMOO-UHFFFAOYSA-N
• XLogP: 4.49
• TPSA: 87.20 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 4
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	564.95
LogP ≤ 5	4.49
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-[6-[2-[6-(7-methyl-2H-imidazo[4,5-b]pyridin-2-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2H-imidazo[4,5-b]pyridin-2-ide;palladium(2+)?

The IUPAC name of 7-methyl-3-[6-[2-[6-(7-methyl-2H-imidazo[4,5-b]pyridin-2-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2H-imidazo[4,5-b]pyridin-2-ide;palladium(2+) (CID 58084518) is 7-methyl-3-[6-[2-[6-(7-methyl-2H-imidazo[4,5-b]pyridin-2-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2H-imidazo[4,5-b]pyridin-2-ide;palladium(2+).

What is the SMILES notation for 7-methyl-3-[6-[2-[6-(7-methyl-2H-imidazo[4,5-b]pyridin-2-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2H-imidazo[4,5-b]pyridin-2-ide;palladium(2+)?

The canonical SMILES for 7-methyl-3-[6-[2-[6-(7-methyl-2H-imidazo[4,5-b]pyridin-2-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2H-imidazo[4,5-b]pyridin-2-ide;palladium(2+) is Cc1ccnc2c1n[c-]n2-c1cccc(C(C)(C)c2cccc(-n3[c-]nc4c(C)ccnc43)n2)n1.[Pd+2].

What is the InChIKey of 7-methyl-3-[6-[2-[6-(7-methyl-2H-imidazo[4,5-b]pyridin-2-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2H-imidazo[4,5-b]pyridin-2-ide;palladium(2+)?

The InChIKey is VVMFBKDTBRCMOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22N8.Pd/c1-17-11-13-28-25-23(17)30-15-34(25)21-9-5-7-19(32-21)27(3,4)20-8-6-10-22(33-20)35-16-31-24-18(2)12-14-29-26(24)35;/h5-14H,1-4H3;/q-2;+2.

What are the key properties of 7-methyl-3-[6-[2-[6-(7-methyl-2H-imidazo[4,5-b]pyridin-2-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2H-imidazo[4,5-b]pyridin-2-ide;palladium(2+)?

7-methyl-3-[6-[2-[6-(7-methyl-2H-imidazo[4,5-b]pyridin-2-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2H-imidazo[4,5-b]pyridin-2-ide;palladium(2+) has a molecular weight of 564.95 g/mol, XLogP of 4.49, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 7-methyl-3-[6-[2-[6-(7-methyl-2H-imidazo[4,5-b]pyridin-2-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2H-imidazo[4,5-b]pyridin-2-ide;palladium(2+) is sourced from PubChem (CID 58084518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).