2-[[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-difluoromethyl]-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum

C61H45F2N4Pt-3 — CID 162704591

About 2-[[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-difluoromethyl]-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum

2-[[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-difluoromethyl]-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (PubChem CID 162704591) has the molecular formula C61H45F2N4Pt-3 and a molecular weight of 1067.13 g/mol. Its IUPAC name is 2-[[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-difluoromethyl]-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-difluoromethyl]-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• PubChem CID: 162704591
• Molecular Formula: C61H45F2N4Pt-3
• Molecular Weight: 1067.13 g/mol
• Exact Mass: 1066.33
• IUPAC Name: 2-[[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-difluoromethyl]-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• SMILES: FC(F)(c1[c-]c(N2[CH-]N(c3c(-c4ccccc4)cccc3-c3ccccc3)c3ccccc32)ccc1)c1[c-]c2c(cc1)c1ccccc1n2-c1cc(C2(c3ccccc3)CCCCC2)ccn1.[Pt]
• InChI: InChI=1S/C61H45F2N4.Pt/c62-61(63,48-33-34-53-52-27-11-12-30-54(52)67(57(53)40-48)58-41-46(35-38-64-58)60(36-15-4-16-37-60)45-23-9-3-10-24-45)47-25-17-26-49(39-47)65-42-66(56-32-14-13-31-55(56)65)59-50(43-19-5-1-6-20-43)28-18-29-51(59)44-21-7-2-8-22-44;/h1-3,5-14,17-35,38,41-42H,4,15-16,36-37H2;/q-3
• InChIKey: YEFSYSQPNVCLHB-UHFFFAOYSA-N
• XLogP: 15.91
• TPSA: 24.30 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 9
• Heavy Atoms: 68
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1067.13
LogP ≤ 5	15.91
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 2-[[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-difluoromethyl]-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-difluoromethyl]-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (CID 162704591) is 2-[[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-difluoromethyl]-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

What is the SMILES notation for 2-[[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-difluoromethyl]-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The canonical SMILES for 2-[[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-difluoromethyl]-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is FC(F)(c1[c-]c(N2[CH-]N(c3c(-c4ccccc4)cccc3-c3ccccc3)c3ccccc32)ccc1)c1[c-]c2c(cc1)c1ccccc1n2-c1cc(C2(c3ccccc3)CCCCC2)ccn1.[Pt].

What is the InChIKey of 2-[[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-difluoromethyl]-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The InChIKey is YEFSYSQPNVCLHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H45F2N4.Pt/c62-61(63,48-33-34-53-52-27-11-12-30-54(52)67(57(53)40-48)58-41-46(35-38-64-58)60(36-15-4-16-37-60)45-23-9-3-10-24-45)47-25-17-26-49(39-47)65-42-66(56-32-14-13-31-55(56)65)59-50(43-19-5-1-6-20-43)28-18-29-51(59)44-21-7-2-8-22-44;/h1-3,5-14,17-35,38,41-42H,4,15-16,36-37H2;/q-3;.

What are the key properties of 2-[[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-difluoromethyl]-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

2-[[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-difluoromethyl]-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum has a molecular weight of 1067.13 g/mol, XLogP of 15.91, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]-difluoromethyl]-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 162704591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).