2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum

C115H118N6O2Pt2-2 — CID 163959578

IUPAC2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum
SMILESCc1cc(-c2nc3c(-c4[c-]c(-c5cc(-c6ccc(C(C)(C)C)cc6)ccn5)cc(C(C)(C)C)c4)cccc3n2-c2ccc(C(C)(C)C)cc2-c2ccccc2)c(O)c(C(C)(C)C)c1.Cc1ccc(-n2c(-c3cc(C)cc(C(C)(C)C)c3O)nc3c(-c4[c-]c(-c5cc(-c6ccc(C(C)(C)C)cc6)ccn5)cc(C(C)(C)C)c4)cccc32)c(-c2ccccc2)c1.[Pt].[Pt]
InChIInChI=1S/C59H62N3O.C56H56N3O.2Pt/c1-37-30-48(54(63)49(31-37)59(11,12)13)55-61-53-46(20-17-21-52(53)62(55)51-27-26-44(57(5,6)7)36-47(51)39-18-15-14-16-19-39)41-32-42(34-45(33-41)58(8,9)10)50-35-40(28-29-60-50)38-22-24-43(25-23-38)56(2,3)4;1-35-20-25-49(45(28-35)38-16-13-12-14-17-38)59-50-19-15-18-44(51(50)58-53(59)46-29-36(2)30-47(52(46)60)56(9,10)11)40-31-41(33-43(32-40)55(6,7)8)48-34-39(26-27-57-48)37-21-23-42(24-22-37)54(3,4)5;;/h14-31,33-36,63H,1-13H3;12-30,32-34,60H,1-11H3;;/q2*-1;;
InChIKeyOZVMIJYDZUZYRP-UHFFFAOYSA-N
MW2006.40 g/mol
LogP30.53
Rot. Bonds12

About 2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum

2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum (PubChem CID 163959578) has the molecular formula C115H118N6O2Pt2-2 and a molecular weight of 2006.40 g/mol. Its IUPAC name is 2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum.

Molecular Properties

Compound Name2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum
PubChem CID163959578
Molecular FormulaC115H118N6O2Pt2-2
Molecular Weight2006.40 g/mol
Exact Mass2004.86
IUPAC Name2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum
SMILESCc1cc(-c2nc3c(-c4[c-]c(-c5cc(-c6ccc(C(C)(C)C)cc6)ccn5)cc(C(C)(C)C)c4)cccc3n2-c2ccc(C(C)(C)C)cc2-c2ccccc2)c(O)c(C(C)(C)C)c1.Cc1ccc(-n2c(-c3cc(C)cc(C(C)(C)C)c3O)nc3c(-c4[c-]c(-c5cc(-c6ccc(C(C)(C)C)cc6)ccn5)cc(C(C)(C)C)c4)cccc32)c(-c2ccccc2)c1.[Pt].[Pt]
InChIInChI=1S/C59H62N3O.C56H56N3O.2Pt/c1-37-30-48(54(63)49(31-37)59(11,12)13)55-61-53-46(20-17-21-52(53)62(55)51-27-26-44(57(5,6)7)36-47(51)39-18-15-14-16-19-39)41-32-42(34-45(33-41)58(8,9)10)50-35-40(28-29-60-50)38-22-24-43(25-23-38)56(2,3)4;1-35-20-25-49(45(28-35)38-16-13-12-14-17-38)59-50-19-15-18-44(51(50)58-53(59)46-29-36(2)30-47(52(46)60)56(9,10)11)40-31-41(33-43(32-40)55(6,7)8)48-34-39(26-27-57-48)37-21-23-42(24-22-37)54(3,4)5;;/h14-31,33-36,63H,1-13H3;12-30,32-34,60H,1-11H3;;/q2*-1;;
InChIKeyOZVMIJYDZUZYRP-UHFFFAOYSA-N
XLogP30.53
TPSA101.88 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms125
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002006.40
LogP ≤ 530.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze 2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum?
The IUPAC name of 2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum (CID 163959578) is 2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum.
What is the SMILES notation for 2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum?
The canonical SMILES for 2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum is Cc1cc(-c2nc3c(-c4[c-]c(-c5cc(-c6ccc(C(C)(C)C)cc6)ccn5)cc(C(C)(C)C)c4)cccc3n2-c2ccc(C(C)(C)C)cc2-c2ccccc2)c(O)c(C(C)(C)C)c1.Cc1ccc(-n2c(-c3cc(C)cc(C(C)(C)C)c3O)nc3c(-c4[c-]c(-c5cc(-c6ccc(C(C)(C)C)cc6)ccn5)cc(C(C)(C)C)c4)cccc32)c(-c2ccccc2)c1.[Pt].[Pt].
What is the InChIKey of 2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum?
The InChIKey is OZVMIJYDZUZYRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H62N3O.C56H56N3O.2Pt/c1-37-30-48(54(63)49(31-37)59(11,12)13)55-61-53-46(20-17-21-52(53)62(55)51-27-26-44(57(5,6)7)36-47(51)39-18-15-14-16-19-39)41-32-42(34-45(33-41)58(8,9)10)50-35-40(28-29-60-50)38-22-24-43(25-23-38)56(2,3)4;1-35-20-25-49(45(28-35)38-16-13-12-14-17-38)59-50-19-15-18-44(51(50)58-53(59)46-29-36(2)30-47(52(46)60)56(9,10)11)40-31-41(33-43(32-40)55(6,7)8)48-34-39(26-27-57-48)37-21-23-42(24-22-37)54(3,4)5;;/h14-31,33-36,63H,1-13H3;12-30,32-34,60H,1-11H3;;/q2*-1;;.
What are the key properties of 2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum?
2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum has a molecular weight of 2006.40 g/mol, XLogP of 30.53, 12 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;2-tert-butyl-6-[4-[3-tert-butyl-5-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-methyl-2-phenylphenyl)benzimidazol-2-yl]-4-methylphenol;platinum is sourced from PubChem (CID 163959578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).