8-(4-tert-butyl-2-pyridinyl)-6-[9-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-2,3-dimethyl-7H-imidazo[1,2-a]pyridin-7-ide;platinum(2+)

C₄₈H₄₁N₅Pt — CID 155633365

About 8-(4-tert-butyl-2-pyridinyl)-6-[9-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-2,3-dimethyl-7H-imidazo[1,2-a]pyridin-7-ide;platinum(2+)

8-(4-tert-butyl-2-pyridinyl)-6-[9-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-2,3-dimethyl-7H-imidazo[1,2-a]pyridin-7-ide;platinum(2+) (PubChem CID 155633365) has the molecular formula C₄₈H₄₁N₅Pt and a molecular weight of 882.97 g/mol. Its IUPAC name is 8-(4-tert-butyl-2-pyridinyl)-6-[9-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-2,3-dimethyl-7H-imidazo[1,2-a]pyridin-7-ide;platinum(2+).

Molecular Properties

• Compound Name: 8-(4-tert-butyl-2-pyridinyl)-6-[9-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-2,3-dimethyl-7H-imidazo[1,2-a]pyridin-7-ide;platinum(2+)
• PubChem CID: 155633365
• Molecular Formula: C₄₈H₄₁N₅Pt
• Molecular Weight: 882.97 g/mol
• Exact Mass: 882.30
• IUPAC Name: 8-(4-tert-butyl-2-pyridinyl)-6-[9-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-2,3-dimethyl-7H-imidazo[1,2-a]pyridin-7-ide;platinum(2+)
• SMILES: Cc1nn(-c2[c-]c(C3(c4[c-]c(-c5cc(C(C)(C)C)ccn5)c5nc(C)c(C)n5c4)c4ccccc4-c4ccccc43)ccc2)c(C)c1-c1ccccc1.[Pt+2]
• InChI: InChI=1S/C48H41N5.Pt/c1-30-32(3)52-29-37(27-41(46(52)50-30)44-28-35(24-25-49-44)47(5,6)7)48(42-22-13-11-20-39(42)40-21-12-14-23-43(40)48)36-18-15-19-38(26-36)53-33(4)45(31(2)51-53)34-16-9-8-10-17-34;/h8-25,28-29H,1-7H3;/q-2;+2
• InChIKey: KVKMSWILPFJWOS-UHFFFAOYSA-N
• XLogP: 10.74
• TPSA: 48.01 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 54
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	882.97
LogP ≤ 5	10.74
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 8-(4-tert-butyl-2-pyridinyl)-6-[9-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-2,3-dimethyl-7H-imidazo[1,2-a]pyridin-7-ide;platinum(2+)?

The IUPAC name of 8-(4-tert-butyl-2-pyridinyl)-6-[9-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-2,3-dimethyl-7H-imidazo[1,2-a]pyridin-7-ide;platinum(2+) (CID 155633365) is 8-(4-tert-butyl-2-pyridinyl)-6-[9-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-2,3-dimethyl-7H-imidazo[1,2-a]pyridin-7-ide;platinum(2+).

What is the SMILES notation for 8-(4-tert-butyl-2-pyridinyl)-6-[9-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-2,3-dimethyl-7H-imidazo[1,2-a]pyridin-7-ide;platinum(2+)?

The canonical SMILES for 8-(4-tert-butyl-2-pyridinyl)-6-[9-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-2,3-dimethyl-7H-imidazo[1,2-a]pyridin-7-ide;platinum(2+) is Cc1nn(-c2[c-]c(C3(c4[c-]c(-c5cc(C(C)(C)C)ccn5)c5nc(C)c(C)n5c4)c4ccccc4-c4ccccc43)ccc2)c(C)c1-c1ccccc1.[Pt+2].

What is the InChIKey of 8-(4-tert-butyl-2-pyridinyl)-6-[9-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-2,3-dimethyl-7H-imidazo[1,2-a]pyridin-7-ide;platinum(2+)?

The InChIKey is KVKMSWILPFJWOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H41N5.Pt/c1-30-32(3)52-29-37(27-41(46(52)50-30)44-28-35(24-25-49-44)47(5,6)7)48(42-22-13-11-20-39(42)40-21-12-14-23-43(40)48)36-18-15-19-38(26-36)53-33(4)45(31(2)51-53)34-16-9-8-10-17-34;/h8-25,28-29H,1-7H3;/q-2;+2.

What are the key properties of 8-(4-tert-butyl-2-pyridinyl)-6-[9-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-2,3-dimethyl-7H-imidazo[1,2-a]pyridin-7-ide;platinum(2+)?

8-(4-tert-butyl-2-pyridinyl)-6-[9-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-2,3-dimethyl-7H-imidazo[1,2-a]pyridin-7-ide;platinum(2+) has a molecular weight of 882.97 g/mol, XLogP of 10.74, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 8-(4-tert-butyl-2-pyridinyl)-6-[9-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-2,3-dimethyl-7H-imidazo[1,2-a]pyridin-7-ide;platinum(2+) is sourced from PubChem (CID 155633365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 155633365 — identifiers, structure, computed properties (public domain)

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