2-tert-butyl-4-methyl-6-[1-[4-(2-methylbutan-2-yl)-2-phenylphenyl]-4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-tert-butyl-4-methyl-6-[4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(2-methylpropyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum

C117H106N6O2Pt2-2 — CID 163824041

About 2-tert-butyl-4-methyl-6-[1-[4-(2-methylbutan-2-yl)-2-phenylphenyl]-4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-tert-butyl-4-methyl-6-[4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(2-methylpropyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum

2-tert-butyl-4-methyl-6-[1-[4-(2-methylbutan-2-yl)-2-phenylphenyl]-4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-tert-butyl-4-methyl-6-[4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(2-methylpropyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum (PubChem CID 163824041) has the molecular formula C117H106N6O2Pt2-2 and a molecular weight of 2018.33 g/mol. Its IUPAC name is 2-tert-butyl-4-methyl-6-[1-[4-(2-methylbutan-2-yl)-2-phenylphenyl]-4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-tert-butyl-4-methyl-6-[4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(2-methylpropyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum.

Molecular Properties

• Compound Name: 2-tert-butyl-4-methyl-6-[1-[4-(2-methylbutan-2-yl)-2-phenylphenyl]-4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-tert-butyl-4-methyl-6-[4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(2-methylpropyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum
• PubChem CID: 163824041
• Molecular Formula: C117H106N6O2Pt2-2
• Molecular Weight: 2018.33 g/mol
• Exact Mass: 2016.77
• IUPAC Name: 2-tert-butyl-4-methyl-6-[1-[4-(2-methylbutan-2-yl)-2-phenylphenyl]-4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-tert-butyl-4-methyl-6-[4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(2-methylpropyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum
• SMILES: CCC(C)(C)c1ccc(-n2c(-c3cc(C)cc(C(C)(C)C)c3O)nc3c(-c4[c-]c(-c5cc(-c6ccc(C)cc6)ccn5)cc(-c5ccccc5)c4)cccc32)c(-c2ccccc2)c1.Cc1ccc(-c2ccnc(-c3[c-]c(-c4cccc5c4nc(-c4cc(C)cc(C(C)(C)C)c4O)n5-c4ccc(CC(C)C)cc4-c4ccccc4)cc(-c4ccccc4)c3)c2)cc1.[Pt].[Pt]
• InChI: InChI=1S/C59H54N3O.C58H52N3O.2Pt/c1-9-59(7,8)47-27-28-53(49(37-47)42-19-14-11-15-20-42)62-54-22-16-21-48(55(54)61-57(62)50-31-39(3)32-51(56(50)63)58(4,5)6)45-33-44(40-17-12-10-13-18-40)34-46(35-45)52-36-43(29-30-60-52)41-25-23-38(2)24-26-41;1-37(2)29-40-23-26-53(49(32-40)43-17-12-9-13-18-43)61-54-20-14-19-48(55(54)60-57(61)50-30-39(4)31-51(56(50)62)58(5,6)7)46-33-45(41-15-10-8-11-16-41)34-47(35-46)52-36-44(27-28-59-52)42-24-21-38(3)22-25-42;;/h10-34,36-37,63H,9H2,1-8H3;8-28,30-34,36-37,62H,29H2,1-7H3;;/q2*-1
• InChIKey: URSQIRISLCTDBO-UHFFFAOYSA-N
• XLogP: 30.57
• TPSA: 101.88 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 8
• Rotatable Bonds: 18
• Heavy Atoms: 127
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2018.33
LogP ≤ 5	30.57
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-4-methyl-6-[1-[4-(2-methylbutan-2-yl)-2-phenylphenyl]-4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-tert-butyl-4-methyl-6-[4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(2-methylpropyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum?

The IUPAC name of 2-tert-butyl-4-methyl-6-[1-[4-(2-methylbutan-2-yl)-2-phenylphenyl]-4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-tert-butyl-4-methyl-6-[4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(2-methylpropyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum (CID 163824041) is 2-tert-butyl-4-methyl-6-[1-[4-(2-methylbutan-2-yl)-2-phenylphenyl]-4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-tert-butyl-4-methyl-6-[4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(2-methylpropyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum.

What is the SMILES notation for 2-tert-butyl-4-methyl-6-[1-[4-(2-methylbutan-2-yl)-2-phenylphenyl]-4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-tert-butyl-4-methyl-6-[4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(2-methylpropyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum?

The canonical SMILES for 2-tert-butyl-4-methyl-6-[1-[4-(2-methylbutan-2-yl)-2-phenylphenyl]-4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-tert-butyl-4-methyl-6-[4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(2-methylpropyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum is CCC(C)(C)c1ccc(-n2c(-c3cc(C)cc(C(C)(C)C)c3O)nc3c(-c4[c-]c(-c5cc(-c6ccc(C)cc6)ccn5)cc(-c5ccccc5)c4)cccc32)c(-c2ccccc2)c1.Cc1ccc(-c2ccnc(-c3[c-]c(-c4cccc5c4nc(-c4cc(C)cc(C(C)(C)C)c4O)n5-c4ccc(CC(C)C)cc4-c4ccccc4)cc(-c4ccccc4)c3)c2)cc1.[Pt].[Pt].

What is the InChIKey of 2-tert-butyl-4-methyl-6-[1-[4-(2-methylbutan-2-yl)-2-phenylphenyl]-4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-tert-butyl-4-methyl-6-[4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(2-methylpropyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum?

The InChIKey is URSQIRISLCTDBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H54N3O.C58H52N3O.2Pt/c1-9-59(7,8)47-27-28-53(49(37-47)42-19-14-11-15-20-42)62-54-22-16-21-48(55(54)61-57(62)50-31-39(3)32-51(56(50)63)58(4,5)6)45-33-44(40-17-12-10-13-18-40)34-46(35-45)52-36-43(29-30-60-52)41-25-23-38(2)24-26-41;1-37(2)29-40-23-26-53(49(32-40)43-17-12-9-13-18-43)61-54-20-14-19-48(55(54)60-57(61)50-30-39(4)31-51(56(50)62)58(5,6)7)46-33-45(41-15-10-8-11-16-41)34-47(35-46)52-36-44(27-28-59-52)42-24-21-38(3)22-25-42;;/h10-34,36-37,63H,9H2,1-8H3;8-28,30-34,36-37,62H,29H2,1-7H3;;/q2*-1;;.

What are the key properties of 2-tert-butyl-4-methyl-6-[1-[4-(2-methylbutan-2-yl)-2-phenylphenyl]-4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-tert-butyl-4-methyl-6-[4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(2-methylpropyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum?

2-tert-butyl-4-methyl-6-[1-[4-(2-methylbutan-2-yl)-2-phenylphenyl]-4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-tert-butyl-4-methyl-6-[4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(2-methylpropyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum has a molecular weight of 2018.33 g/mol, XLogP of 30.57, 18 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 2-tert-butyl-4-methyl-6-[1-[4-(2-methylbutan-2-yl)-2-phenylphenyl]-4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-tert-butyl-4-methyl-6-[4-[3-[4-(4-methylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(2-methylpropyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum is sourced from PubChem (CID 163824041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).