2-[3-[3-[2,6-bis[3,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum

C250H250N12O3Pt3-6 — CID 158832387

About 2-[3-[3-[2,6-bis[3,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum

2-[3-[3-[2,6-bis[3,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (PubChem CID 158832387) has the molecular formula C250H250N12O3Pt3-6 and a molecular weight of 4056.06 g/mol. Its IUPAC name is 2-[3-[3-[2,6-bis[3,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[3-[3-[2,6-bis[3,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• PubChem CID: 158832387
• Molecular Formula: C250H250N12O3Pt3-6
• Molecular Weight: 4056.06 g/mol
• Exact Mass: 4052.88
• IUPAC Name: 2-[3-[3-[2,6-bis[3,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(-n2[c-][n+](-c3c(-c4cc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)cc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)c4)cccc3-c3cc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)cc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c3)c3ccccc32)c1.CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(-n2[c-][n+](-c3c(-c4ccc(-c5ccccc5)cc4)cccc3-c3ccc(-c4ccccc4)cc3)c3ccccc32)c1.CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(-n2[c-][n+](-c3c(-c4ccc5c(c4)C(C)(C)CC5(C)C)cccc3-c3ccc4c(c3)C(C)(C)CC4(C)C)c3ccccc32)c1.[Pt].[Pt].[Pt]
• InChI: InChI=1S/C112H126N4O.C70H70N4O.C68H54N4O.3Pt/c1-103(2,3)80-44-45-113-101(66-80)116-97-39-32-31-36-95(97)96-43-42-91(68-100(96)116)117-92-65-89(112(28,29)30)64-90(67-92)114-69-115(99-41-34-33-40-98(99)114)102-93(78-48-70(74-52-81(104(4,5)6)60-82(53-74)105(7,8)9)46-71(49-78)75-54-83(106(10,11)12)61-84(55-75)107(13,14)15)37-35-38-94(102)79-50-72(76-56-85(108(16,17)18)62-86(57-76)109(19,20)21)47-73(51-79)77-58-87(110(22,23)24)63-88(59-77)111(25,26)27;1-65(2,3)46-32-33-71-63(38-46)74-59-23-16-15-20-53(59)54-29-28-49(40-62(54)74)75-50-37-47(66(4,5)6)36-48(39-50)72-43-73(61-25-18-17-24-60(61)72)64-51(44-26-30-55-57(34-44)69(11,12)41-67(55,7)8)21-19-22-52(64)45-27-31-56-58(35-45)70(13,14)42-68(56,9)10;1-67(2,3)52-38-39-69-65(42-52)72-61-25-14-13-22-59(61)60-37-36-55(44-64(60)72)73-56-41-53(68(4,5)6)40-54(43-56)70-45-71(63-27-16-15-26-62(63)70)66-57(50-32-28-48(29-33-50)46-18-9-7-10-19-46)23-17-24-58(66)51-34-30-49(31-35-51)47-20-11-8-12-21-47;;;/h31-66H,1-30H3;15-38H,41-42H2,1-14H3;7-42H,1-6H3;;;/q3*-2
• InChIKey: VEMPULUJSCURCC-UHFFFAOYSA-N
• XLogP: 64.86
• TPSA: 107.58 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 27
• Heavy Atoms: 268
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4056.06
LogP ≤ 5	64.86
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 2-[3-[3-[2,6-bis[3,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[3-[3-[2,6-bis[3,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (CID 158832387) is 2-[3-[3-[2,6-bis[3,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum.

What is the SMILES notation for 2-[3-[3-[2,6-bis[3,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

The canonical SMILES for 2-[3-[3-[2,6-bis[3,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(-n2[c-][n+](-c3c(-c4cc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)cc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)c4)cccc3-c3cc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)cc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c3)c3ccccc32)c1.CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(-n2[c-][n+](-c3c(-c4ccc(-c5ccccc5)cc4)cccc3-c3ccc(-c4ccccc4)cc3)c3ccccc32)c1.CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(-n2[c-][n+](-c3c(-c4ccc5c(c4)C(C)(C)CC5(C)C)cccc3-c3ccc4c(c3)C(C)(C)CC4(C)C)c3ccccc32)c1.[Pt].[Pt].[Pt].

What is the InChIKey of 2-[3-[3-[2,6-bis[3,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

The InChIKey is VEMPULUJSCURCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C112H126N4O.C70H70N4O.C68H54N4O.3Pt/c1-103(2,3)80-44-45-113-101(66-80)116-97-39-32-31-36-95(97)96-43-42-91(68-100(96)116)117-92-65-89(112(28,29)30)64-90(67-92)114-69-115(99-41-34-33-40-98(99)114)102-93(78-48-70(74-52-81(104(4,5)6)60-82(53-74)105(7,8)9)46-71(49-78)75-54-83(106(10,11)12)61-84(55-75)107(13,14)15)37-35-38-94(102)79-50-72(76-56-85(108(16,17)18)62-86(57-76)109(19,20)21)47-73(51-79)77-58-87(110(22,23)24)63-88(59-77)111(25,26)27;1-65(2,3)46-32-33-71-63(38-46)74-59-23-16-15-20-53(59)54-29-28-49(40-62(54)74)75-50-37-47(66(4,5)6)36-48(39-50)72-43-73(61-25-18-17-24-60(61)72)64-51(44-26-30-55-57(34-44)69(11,12)41-67(55,7)8)21-19-22-52(64)45-27-31-56-58(35-45)70(13,14)42-68(56,9)10;1-67(2,3)52-38-39-69-65(42-52)72-61-25-14-13-22-59(61)60-37-36-55(44-64(60)72)73-56-41-53(68(4,5)6)40-54(43-56)70-45-71(63-27-16-15-26-62(63)70)66-57(50-32-28-48(29-33-50)46-18-9-7-10-19-46)23-17-24-58(66)51-34-30-49(31-35-51)47-20-11-8-12-21-47;;;/h31-66H,1-30H3;15-38H,41-42H2,1-14H3;7-42H,1-6H3;;;/q3*-2;;;.

What are the key properties of 2-[3-[3-[2,6-bis[3,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

2-[3-[3-[2,6-bis[3,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum has a molecular weight of 4056.06 g/mol, XLogP of 64.86, 27 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[3-[2,6-bis[3,5-bis(3,5-ditert-butylphenyl)phenyl]phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(4-phenylphenyl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[3-[2,6-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)phenyl]-2H-benzimidazol-3-ium-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 158832387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).