9-(3-fluoro-2-pyridinyl)-2-[3-[(4-fluoro-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)

C28H15F2N3OPt — CID 153421700

About 9-(3-fluoro-2-pyridinyl)-2-[3-[(4-fluoro-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)

9-(3-fluoro-2-pyridinyl)-2-[3-[(4-fluoro-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+) (PubChem CID 153421700) has the molecular formula C28H15F2N3OPt and a molecular weight of 642.52 g/mol. Its IUPAC name is 9-(3-fluoro-2-pyridinyl)-2-[3-[(4-fluoro-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+).

Molecular Properties

• Compound Name: 9-(3-fluoro-2-pyridinyl)-2-[3-[(4-fluoro-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)
• PubChem CID: 153421700
• Molecular Formula: C28H15F2N3OPt
• Molecular Weight: 642.52 g/mol
• Exact Mass: 642.08
• IUPAC Name: 9-(3-fluoro-2-pyridinyl)-2-[3-[(4-fluoro-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)
• SMILES: Fc1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3ncccc3F)ccc2)c1.[Pt+2]
• InChI: InChI=1S/C28H15F2N3O.Pt/c29-20-12-14-31-27(17-20)34-21-6-3-5-18(15-21)19-10-11-23-22-7-1-2-9-25(22)33(26(23)16-19)28-24(30)8-4-13-32-28;/h1-14,17H;/q-2;+2
• InChIKey: FJNUWAXXMADZJF-UHFFFAOYSA-N
• XLogP: 6.91
• TPSA: 39.94 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	642.52
LogP ≤ 5	6.91
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 9-(3-fluoro-2-pyridinyl)-2-[3-[(4-fluoro-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)?

The IUPAC name of 9-(3-fluoro-2-pyridinyl)-2-[3-[(4-fluoro-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+) (CID 153421700) is 9-(3-fluoro-2-pyridinyl)-2-[3-[(4-fluoro-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+).

What is the SMILES notation for 9-(3-fluoro-2-pyridinyl)-2-[3-[(4-fluoro-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)?

The canonical SMILES for 9-(3-fluoro-2-pyridinyl)-2-[3-[(4-fluoro-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+) is Fc1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3ncccc3F)ccc2)c1.[Pt+2].

What is the InChIKey of 9-(3-fluoro-2-pyridinyl)-2-[3-[(4-fluoro-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)?

The InChIKey is FJNUWAXXMADZJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H15F2N3O.Pt/c29-20-12-14-31-27(17-20)34-21-6-3-5-18(15-21)19-10-11-23-22-7-1-2-9-25(22)33(26(23)16-19)28-24(30)8-4-13-32-28;/h1-14,17H;/q-2;+2.

What are the key properties of 9-(3-fluoro-2-pyridinyl)-2-[3-[(4-fluoro-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)?

9-(3-fluoro-2-pyridinyl)-2-[3-[(4-fluoro-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+) has a molecular weight of 642.52 g/mol, XLogP of 6.91, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(3-fluoro-2-pyridinyl)-2-[3-[(4-fluoro-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+) is sourced from PubChem (CID 153421700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).