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

C215H227N12O3Pt3-9 — CID 160723891

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

2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum (PubChem CID 160723891) has the molecular formula C215H227N12O3Pt3-9 and a molecular weight of 3612.50 g/mol. Its IUPAC name is 2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum
• PubChem CID: 160723891
• Molecular Formula: C215H227N12O3Pt3-9
• Molecular Weight: 3612.50 g/mol
• Exact Mass: 3609.70
• IUPAC Name: 2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1cc(Oc2[c-]c3c(c(C(C)(C)c4ccccc4)c2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(N2[CH-]N(c3cccc(C(C)(C)c4ccccc4)c3)c3cc(C(C)(C)C)c(C(C)(C)C)cc32)c1.CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2cc(C(C)(C)c4ccccc4)ccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(N2[CH-]N(c3cc(C(C)(C)c4ccccc4)cc(C(C)(C)c4ccccc4)c3)c3ccc(C(C)(C)C)cc32)c1.CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2cc(C(C)(C)c4ccccc4)ccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(N2[CH-]N(c3cccc(C(C)(C)c4ccccc4)c3)c3cc(C(C)(C)C)c(C(C)(C)C)cc32)c1.[Pt].[Pt].[Pt]
• InChI: InChI=1S/C75H77N4O.2C70H75N4O.3Pt/c1-70(2,3)53-31-36-66-68(45-53)78(49-77(66)59-41-57(74(12,13)51-27-21-17-22-28-51)39-58(42-59)75(14,15)52-29-23-18-24-30-52)60-40-56(72(7,8)9)43-62(47-60)80-61-33-34-63-64-44-55(73(10,11)50-25-19-16-20-26-50)32-35-65(64)79(67(63)48-61)69-46-54(37-38-76-69)71(4,5)6;1-65(2,3)48-34-35-71-63(39-48)74-59-33-24-23-32-55(59)64-58(70(15,16)47-28-21-18-22-29-47)41-54(42-62(64)74)75-53-38-50(66(4,5)6)37-52(40-53)73-45-72(60-43-56(67(7,8)9)57(44-61(60)73)68(10,11)12)51-31-25-30-49(36-51)69(13,14)46-26-19-17-20-27-46;1-65(2,3)48-34-35-71-64(40-48)74-60-33-30-50(70(15,16)47-26-21-18-22-27-47)39-57(60)56-32-31-54(42-61(56)74)75-55-38-51(66(4,5)6)37-53(41-55)73-45-72(62-43-58(67(7,8)9)59(44-63(62)73)68(10,11)12)52-29-23-28-49(36-52)69(13,14)46-24-19-17-20-25-46;;;/h16-46,49H,1-15H3;17-39,41,43-45H,1-16H3;17-40,43-45H,1-16H3;;;/q3*-3
• InChIKey: IMNSSGHPHYRAAG-UHFFFAOYSA-N
• XLogP: 57.49
• TPSA: 100.59 Ų
• H-Bond Acceptors: 15
• Rotatable Bonds: 29
• Heavy Atoms: 233
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3612.50
LogP ≤ 5	57.49
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-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum (CID 160723891) is 2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum is CC(C)(C)c1cc(Oc2[c-]c3c(c(C(C)(C)c4ccccc4)c2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(N2[CH-]N(c3cccc(C(C)(C)c4ccccc4)c3)c3cc(C(C)(C)C)c(C(C)(C)C)cc32)c1.CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2cc(C(C)(C)c4ccccc4)ccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(N2[CH-]N(c3cc(C(C)(C)c4ccccc4)cc(C(C)(C)c4ccccc4)c3)c3ccc(C(C)(C)C)cc32)c1.CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2cc(C(C)(C)c4ccccc4)ccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(N2[CH-]N(c3cccc(C(C)(C)c4ccccc4)c3)c3cc(C(C)(C)C)c(C(C)(C)C)cc32)c1.[Pt].[Pt].[Pt].

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

The InChIKey is IMNSSGHPHYRAAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C75H77N4O.2C70H75N4O.3Pt/c1-70(2,3)53-31-36-66-68(45-53)78(49-77(66)59-41-57(74(12,13)51-27-21-17-22-28-51)39-58(42-59)75(14,15)52-29-23-18-24-30-52)60-40-56(72(7,8)9)43-62(47-60)80-61-33-34-63-64-44-55(73(10,11)50-25-19-16-20-26-50)32-35-65(64)79(67(63)48-61)69-46-54(37-38-76-69)71(4,5)6;1-65(2,3)48-34-35-71-63(39-48)74-59-33-24-23-32-55(59)64-58(70(15,16)47-28-21-18-22-29-47)41-54(42-62(64)74)75-53-38-50(66(4,5)6)37-52(40-53)73-45-72(60-43-56(67(7,8)9)57(44-61(60)73)68(10,11)12)51-31-25-30-49(36-51)69(13,14)46-26-19-17-20-27-46;1-65(2,3)48-34-35-71-64(40-48)74-60-33-30-50(70(15,16)47-26-21-18-22-27-47)39-57(60)56-32-31-54(42-61(56)74)75-55-38-51(66(4,5)6)37-53(41-55)73-45-72(62-43-58(67(7,8)9)59(44-63(62)73)68(10,11)12)52-29-23-28-49(36-52)69(13,14)46-24-19-17-20-25-46;;;/h16-46,49H,1-15H3;17-39,41,43-45H,1-16H3;17-40,43-45H,1-16H3;;;/q3*-3;;;.

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

2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum has a molecular weight of 3612.50 g/mol, XLogP of 57.49, 29 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-tert-butyl-5-[5,6-ditert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 160723891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).