2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclopentyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum

C183H189N12O3Pt3-9 — CID 163829873

About 2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclopentyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum

2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclopentyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (PubChem CID 163829873) has the molecular formula C183H189N12O3Pt3-9 and a molecular weight of 3189.84 g/mol. Its IUPAC name is 2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclopentyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclopentyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• PubChem CID: 163829873
• Molecular Formula: C183H189N12O3Pt3-9
• Molecular Weight: 3189.84 g/mol
• Exact Mass: 3187.40
• IUPAC Name: 2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclopentyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C3(c4ccccc4)C(C)(C)CCCC3(C)C)ccn2)[c-]c(N2[CH-]N(c3c(C(C)(C)C)cccc3C(C)(C)C)c3ccccc32)c1.CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C3(c4ccccc4)CCCC3)ccn2)[c-]c(N2[CH-]N(c3c(C(C)(C)C)cccc3C(C)(C)C)c3ccccc32)c1.CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C3(c4ccccc4)CCCCC3)ccn2)[c-]c(N2[CH-]N(c3c(C(C)(C)C)cccc3C(C)(C)C)c3ccccc32)c1.[Pt].[Pt].[Pt]
• InChI: InChI=1S/C64H69N4O.C60H61N4O.C59H59N4O.3Pt/c1-59(2,3)45-37-46(66-42-67(55-30-20-19-29-54(55)66)58-51(60(4,5)6)26-21-27-52(58)61(7,8)9)40-48(38-45)69-47-31-32-50-49-25-17-18-28-53(49)68(56(50)41-47)57-39-44(33-36-65-57)64(43-23-15-14-16-24-43)62(10,11)34-22-35-63(64,12)13;1-57(2,3)43-35-44(62-40-63(53-28-17-16-27-52(53)62)56-49(58(4,5)6)24-20-25-50(56)59(7,8)9)38-46(36-43)65-45-29-30-48-47-23-14-15-26-51(47)64(54(48)39-45)55-37-42(31-34-61-55)60(32-18-11-19-33-60)41-21-12-10-13-22-41;1-56(2,3)42-34-43(61-39-62(52-27-16-15-26-51(52)61)55-48(57(4,5)6)23-19-24-49(55)58(7,8)9)37-45(35-42)64-44-28-29-47-46-22-13-14-25-50(46)63(53(47)38-44)54-36-41(30-33-60-54)59(31-17-18-32-59)40-20-11-10-12-21-40;;;/h14-21,23-33,36-39,42H,22,34-35H2,1-13H3;10,12-17,20-31,34-37,40H,11,18-19,32-33H2,1-9H3;10-16,19-30,33-36,39H,17-18,31-32H2,1-9H3;;;/q3*-3
• InChIKey: OKCFFTDQICJYBJ-UHFFFAOYSA-N
• XLogP: 49.24
• TPSA: 100.59 Ų
• H-Bond Acceptors: 15
• Rotatable Bonds: 21
• Heavy Atoms: 201
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3189.84
LogP ≤ 5	49.24
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclopentyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclopentyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (CID 163829873) is 2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclopentyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

What is the SMILES notation for 2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclopentyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The canonical SMILES for 2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclopentyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C3(c4ccccc4)C(C)(C)CCCC3(C)C)ccn2)[c-]c(N2[CH-]N(c3c(C(C)(C)C)cccc3C(C)(C)C)c3ccccc32)c1.CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C3(c4ccccc4)CCCC3)ccn2)[c-]c(N2[CH-]N(c3c(C(C)(C)C)cccc3C(C)(C)C)c3ccccc32)c1.CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C3(c4ccccc4)CCCCC3)ccn2)[c-]c(N2[CH-]N(c3c(C(C)(C)C)cccc3C(C)(C)C)c3ccccc32)c1.[Pt].[Pt].[Pt].

What is the InChIKey of 2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclopentyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The InChIKey is OKCFFTDQICJYBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H69N4O.C60H61N4O.C59H59N4O.3Pt/c1-59(2,3)45-37-46(66-42-67(55-30-20-19-29-54(55)66)58-51(60(4,5)6)26-21-27-52(58)61(7,8)9)40-48(38-45)69-47-31-32-50-49-25-17-18-28-53(49)68(56(50)41-47)57-39-44(33-36-65-57)64(43-23-15-14-16-24-43)62(10,11)34-22-35-63(64,12)13;1-57(2,3)43-35-44(62-40-63(53-28-17-16-27-52(53)62)56-49(58(4,5)6)24-20-25-50(56)59(7,8)9)38-46(36-43)65-45-29-30-48-47-23-14-15-26-51(47)64(54(48)39-45)55-37-42(31-34-61-55)60(32-18-11-19-33-60)41-21-12-10-13-22-41;1-56(2,3)42-34-43(61-39-62(52-27-16-15-26-51(52)61)55-48(57(4,5)6)23-19-24-49(55)58(7,8)9)37-45(35-42)64-44-28-29-47-46-22-13-14-25-50(46)63(53(47)38-44)54-36-41(30-33-60-54)59(31-17-18-32-59)40-20-11-10-12-21-40;;;/h14-21,23-33,36-39,42H,22,34-35H2,1-13H3;10,12-17,20-31,34-37,40H,11,18-19,32-33H2,1-9H3;10-16,19-30,33-36,39H,17-18,31-32H2,1-9H3;;;/q3*-3;;;.

What are the key properties of 2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclopentyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclopentyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum has a molecular weight of 3189.84 g/mol, XLogP of 49.24, 21 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(1-phenylcyclopentyl)-2-pyridinyl]-1H-carbazol-1-ide;2-[3-tert-butyl-5-[3-(2,6-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-[4-(2,2,6,6-tetramethyl-1-phenylcyclohexyl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 163829873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).