7-[3-fluoro-5-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-6-id-1-yl]oxy-9-pyridin-2-yl-8H-carbazol-8-ide-3-carbonitrile;platinum(2+)

C36H24FN5OPt — CID 155635776

About 7-[3-fluoro-5-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-6-id-1-yl]oxy-9-pyridin-2-yl-8H-carbazol-8-ide-3-carbonitrile;platinum(2+)

7-[3-fluoro-5-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-6-id-1-yl]oxy-9-pyridin-2-yl-8H-carbazol-8-ide-3-carbonitrile;platinum(2+) (PubChem CID 155635776) has the molecular formula C36H24FN5OPt and a molecular weight of 756.70 g/mol. Its IUPAC name is 7-[3-fluoro-5-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-6-id-1-yl]oxy-9-pyridin-2-yl-8H-carbazol-8-ide-3-carbonitrile;platinum(2+).

Molecular Properties

• Compound Name: 7-[3-fluoro-5-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-6-id-1-yl]oxy-9-pyridin-2-yl-8H-carbazol-8-ide-3-carbonitrile;platinum(2+)
• PubChem CID: 155635776
• Molecular Formula: C36H24FN5OPt
• Molecular Weight: 756.70 g/mol
• Exact Mass: 756.16
• IUPAC Name: 7-[3-fluoro-5-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-6-id-1-yl]oxy-9-pyridin-2-yl-8H-carbazol-8-ide-3-carbonitrile;platinum(2+)
• SMILES: Cc1cc(C)c(-n2ccnc2-c2[c-]c(Oc3[c-]c4c(cc3)c3cc(C#N)ccc3n4-c3ccccn3)cc(F)c2)c(C)c1.[Pt+2]
• InChI: InChI=1S/C36H24FN5O.Pt/c1-22-14-23(2)35(24(3)15-22)41-13-12-40-36(41)26-17-27(37)19-29(18-26)43-28-8-9-30-31-16-25(21-38)7-10-32(31)42(33(30)20-28)34-6-4-5-11-39-34;/h4-17,19H,1-3H3;/q-2;+2
• InChIKey: IUEZYTGCVNWLJF-UHFFFAOYSA-N
• XLogP: 8.36
• TPSA: 68.66 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 44
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	756.70
LogP ≤ 5	8.36
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 7-[3-fluoro-5-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-6-id-1-yl]oxy-9-pyridin-2-yl-8H-carbazol-8-ide-3-carbonitrile;platinum(2+)?

The IUPAC name of 7-[3-fluoro-5-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-6-id-1-yl]oxy-9-pyridin-2-yl-8H-carbazol-8-ide-3-carbonitrile;platinum(2+) (CID 155635776) is 7-[3-fluoro-5-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-6-id-1-yl]oxy-9-pyridin-2-yl-8H-carbazol-8-ide-3-carbonitrile;platinum(2+).

What is the SMILES notation for 7-[3-fluoro-5-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-6-id-1-yl]oxy-9-pyridin-2-yl-8H-carbazol-8-ide-3-carbonitrile;platinum(2+)?

The canonical SMILES for 7-[3-fluoro-5-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-6-id-1-yl]oxy-9-pyridin-2-yl-8H-carbazol-8-ide-3-carbonitrile;platinum(2+) is Cc1cc(C)c(-n2ccnc2-c2[c-]c(Oc3[c-]c4c(cc3)c3cc(C#N)ccc3n4-c3ccccn3)cc(F)c2)c(C)c1.[Pt+2].

What is the InChIKey of 7-[3-fluoro-5-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-6-id-1-yl]oxy-9-pyridin-2-yl-8H-carbazol-8-ide-3-carbonitrile;platinum(2+)?

The InChIKey is IUEZYTGCVNWLJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H24FN5O.Pt/c1-22-14-23(2)35(24(3)15-22)41-13-12-40-36(41)26-17-27(37)19-29(18-26)43-28-8-9-30-31-16-25(21-38)7-10-32(31)42(33(30)20-28)34-6-4-5-11-39-34;/h4-17,19H,1-3H3;/q-2;+2.

What are the key properties of 7-[3-fluoro-5-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-6-id-1-yl]oxy-9-pyridin-2-yl-8H-carbazol-8-ide-3-carbonitrile;platinum(2+)?

7-[3-fluoro-5-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-6-id-1-yl]oxy-9-pyridin-2-yl-8H-carbazol-8-ide-3-carbonitrile;platinum(2+) has a molecular weight of 756.70 g/mol, XLogP of 8.36, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 7-[3-fluoro-5-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-6-id-1-yl]oxy-9-pyridin-2-yl-8H-carbazol-8-ide-3-carbonitrile;platinum(2+) is sourced from PubChem (CID 155635776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).