2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum

C267H262N12O4Pt4-4 — CID 163691107

IUPAC2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum
SMILESCc1cc(-n2c(-c3cc(C(C)C)cc(C(C)C)c3O)nc3c(-c4[c-]c(-c5cc(-c6ccc(-c7ccccc7)cc6)ccn5)cc(C(C)(C)C)c4)cccc32)c(-c2ccccc2)cc1-c1ccc(C(C)(C)C)cc1.[2H]C(C)(C)c1cc(-c2nc3c(-c4[c-]c(-c5cc(-c6ccccc6)ccn5)cc(C(C)(C)C)c4)cccc3n2-c2cc(C)c(-c3ccc(C(C)(C)C)cc3)cc2-c2ccccc2)c(O)c(C([2H])(C)C)c1.[2H]C(C)(C)c1ccc(-c2ccnc(-c3[c-]c(-c4cccc5c4nc(-c4cc(C(C)C)cc(C(C)C)c4O)n5-c4cc(C)c(-c5ccc(C(C)(C)C)cc5)cc4-c4ccccc4)cc(-c4ccccc4)c3)c2)cc1.[2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3cc(C(C)C)cc(C(C)C)c3O)n4-c3cc(C)c(-c4ccc(C(C)(C)C)cc4)cc3-c3ccccc3)cc(C(C)(C)C)c2)c([2H])c(-c2c([2H])c([2H])c(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C69H66N3O.C68H64N3O.C67H70N3O.C63H62N3O.4Pt/c1-43(2)52-39-58(44(3)4)66(73)61(40-52)67-71-65-57(53-36-54(38-56(37-53)69(9,10)11)62-41-51(33-34-70-62)48-27-25-47(26-28-48)46-19-14-12-15-20-46)23-18-24-63(65)72(67)64-35-45(5)59(42-60(64)49-21-16-13-17-22-49)50-29-31-55(32-30-50)68(6,7)8;1-42(2)46-24-26-48(27-25-46)51-32-33-69-62(40-51)55-36-53(47-18-13-11-14-19-47)35-54(37-55)57-22-17-23-63-65(57)70-67(61-39-52(43(3)4)38-58(44(5)6)66(61)72)71(63)64-34-45(7)59(41-60(64)49-20-15-12-16-21-49)50-28-30-56(31-29-50)68(8,9)10;1-41(2)48-37-55(42(3)4)63(71)58(38-48)64-69-62-54(49-34-50(36-53(35-49)67(12,13)14)59-39-47(31-32-68-59)44-23-27-51(28-24-44)65(6,7)8)21-18-22-60(62)70(64)61-33-43(5)56(40-57(61)45-19-16-15-17-20-45)46-25-29-52(30-26-46)66(9,10)11;1-39(2)46-35-52(40(3)4)60(67)55(36-46)61-65-59-51(47-32-48(34-50(33-47)63(9,10)11)56-37-45(29-30-64-56)42-19-14-12-15-20-42)23-18-24-57(59)66(61)58-31-41(5)53(38-54(58)43-21-16-13-17-22-43)44-25-27-49(28-26-44)62(6,7)8;;;;/h12-35,37-44,73H,1-11H3;11-36,38-44,72H,1-10H3;15-33,35-42,71H,1-14H3;12-31,33-40,67H,1-11H3;;;;/q4*-1;;;;/i;42D;6D3,7D3,8D3,23D,24D,27D,28D,31D,32D,39D;39D,40D;;;;
InChIKeyNSKRUUFJUANQNC-BQGWDMCQSA-N
MW4502.54 g/mol
LogP72.76
Rot. Bonds39

About 2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum

2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum (PubChem CID 163691107) has the molecular formula C267H262N12O4Pt4-4 and a molecular weight of 4502.54 g/mol. Its IUPAC name is 2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum.

Molecular Properties

Compound Name2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum
PubChem CID163691107
Molecular FormulaC267H262N12O4Pt4-4
Molecular Weight4502.54 g/mol
Exact Mass4499.05
IUPAC Name2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum
SMILESCc1cc(-n2c(-c3cc(C(C)C)cc(C(C)C)c3O)nc3c(-c4[c-]c(-c5cc(-c6ccc(-c7ccccc7)cc6)ccn5)cc(C(C)(C)C)c4)cccc32)c(-c2ccccc2)cc1-c1ccc(C(C)(C)C)cc1.[2H]C(C)(C)c1cc(-c2nc3c(-c4[c-]c(-c5cc(-c6ccccc6)ccn5)cc(C(C)(C)C)c4)cccc3n2-c2cc(C)c(-c3ccc(C(C)(C)C)cc3)cc2-c2ccccc2)c(O)c(C([2H])(C)C)c1.[2H]C(C)(C)c1ccc(-c2ccnc(-c3[c-]c(-c4cccc5c4nc(-c4cc(C(C)C)cc(C(C)C)c4O)n5-c4cc(C)c(-c5ccc(C(C)(C)C)cc5)cc4-c4ccccc4)cc(-c4ccccc4)c3)c2)cc1.[2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3cc(C(C)C)cc(C(C)C)c3O)n4-c3cc(C)c(-c4ccc(C(C)(C)C)cc4)cc3-c3ccccc3)cc(C(C)(C)C)c2)c([2H])c(-c2c([2H])c([2H])c(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C69H66N3O.C68H64N3O.C67H70N3O.C63H62N3O.4Pt/c1-43(2)52-39-58(44(3)4)66(73)61(40-52)67-71-65-57(53-36-54(38-56(37-53)69(9,10)11)62-41-51(33-34-70-62)48-27-25-47(26-28-48)46-19-14-12-15-20-46)23-18-24-63(65)72(67)64-35-45(5)59(42-60(64)49-21-16-13-17-22-49)50-29-31-55(32-30-50)68(6,7)8;1-42(2)46-24-26-48(27-25-46)51-32-33-69-62(40-51)55-36-53(47-18-13-11-14-19-47)35-54(37-55)57-22-17-23-63-65(57)70-67(61-39-52(43(3)4)38-58(44(5)6)66(61)72)71(63)64-34-45(7)59(41-60(64)49-20-15-12-16-21-49)50-28-30-56(31-29-50)68(8,9)10;1-41(2)48-37-55(42(3)4)63(71)58(38-48)64-69-62-54(49-34-50(36-53(35-49)67(12,13)14)59-39-47(31-32-68-59)44-23-27-51(28-24-44)65(6,7)8)21-18-22-60(62)70(64)61-33-43(5)56(40-57(61)45-19-16-15-17-20-45)46-25-29-52(30-26-46)66(9,10)11;1-39(2)46-35-52(40(3)4)60(67)55(36-46)61-65-59-51(47-32-48(34-50(33-47)63(9,10)11)56-37-45(29-30-64-56)42-19-14-12-15-20-42)23-18-24-57(59)66(61)58-31-41(5)53(38-54(58)43-21-16-13-17-22-43)44-25-27-49(28-26-44)62(6,7)8;;;;/h12-35,37-44,73H,1-11H3;11-36,38-44,72H,1-10H3;15-33,35-42,71H,1-14H3;12-31,33-40,67H,1-11H3;;;;/q4*-1;;;;/i;42D;6D3,7D3,8D3,23D,24D,27D,28D,31D,32D,39D;39D,40D;;;;
InChIKeyNSKRUUFJUANQNC-BQGWDMCQSA-N
XLogP72.76
TPSA203.76 Ų
H-Bond Donors4
H-Bond Acceptors16
Rotatable Bonds39
Heavy Atoms287
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004502.54
LogP ≤ 572.76
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1016

Analyze 2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum?
The IUPAC name of 2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum (CID 163691107) is 2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum.
What is the SMILES notation for 2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum?
The canonical SMILES for 2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum is Cc1cc(-n2c(-c3cc(C(C)C)cc(C(C)C)c3O)nc3c(-c4[c-]c(-c5cc(-c6ccc(-c7ccccc7)cc6)ccn5)cc(C(C)(C)C)c4)cccc32)c(-c2ccccc2)cc1-c1ccc(C(C)(C)C)cc1.[2H]C(C)(C)c1cc(-c2nc3c(-c4[c-]c(-c5cc(-c6ccccc6)ccn5)cc(C(C)(C)C)c4)cccc3n2-c2cc(C)c(-c3ccc(C(C)(C)C)cc3)cc2-c2ccccc2)c(O)c(C([2H])(C)C)c1.[2H]C(C)(C)c1ccc(-c2ccnc(-c3[c-]c(-c4cccc5c4nc(-c4cc(C(C)C)cc(C(C)C)c4O)n5-c4cc(C)c(-c5ccc(C(C)(C)C)cc5)cc4-c4ccccc4)cc(-c4ccccc4)c3)c2)cc1.[2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3cc(C(C)C)cc(C(C)C)c3O)n4-c3cc(C)c(-c4ccc(C(C)(C)C)cc4)cc3-c3ccccc3)cc(C(C)(C)C)c2)c([2H])c(-c2c([2H])c([2H])c(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of 2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum?
The InChIKey is NSKRUUFJUANQNC-BQGWDMCQSA-N. The full InChI is InChI=1S/C69H66N3O.C68H64N3O.C67H70N3O.C63H62N3O.4Pt/c1-43(2)52-39-58(44(3)4)66(73)61(40-52)67-71-65-57(53-36-54(38-56(37-53)69(9,10)11)62-41-51(33-34-70-62)48-27-25-47(26-28-48)46-19-14-12-15-20-46)23-18-24-63(65)72(67)64-35-45(5)59(42-60(64)49-21-16-13-17-22-49)50-29-31-55(32-30-50)68(6,7)8;1-42(2)46-24-26-48(27-25-46)51-32-33-69-62(40-51)55-36-53(47-18-13-11-14-19-47)35-54(37-55)57-22-17-23-63-65(57)70-67(61-39-52(43(3)4)38-58(44(5)6)66(61)72)71(63)64-34-45(7)59(41-60(64)49-20-15-12-16-21-49)50-28-30-56(31-29-50)68(8,9)10;1-41(2)48-37-55(42(3)4)63(71)58(38-48)64-69-62-54(49-34-50(36-53(35-49)67(12,13)14)59-39-47(31-32-68-59)44-23-27-51(28-24-44)65(6,7)8)21-18-22-60(62)70(64)61-33-43(5)56(40-57(61)45-19-16-15-17-20-45)46-25-29-52(30-26-46)66(9,10)11;1-39(2)46-35-52(40(3)4)60(67)55(36-46)61-65-59-51(47-32-48(34-50(33-47)63(9,10)11)56-37-45(29-30-64-56)42-19-14-12-15-20-42)23-18-24-57(59)66(61)58-31-41(5)53(38-54(58)43-21-16-13-17-22-43)44-25-27-49(28-26-44)62(6,7)8;;;;/h12-35,37-44,73H,1-11H3;11-36,38-44,72H,1-10H3;15-33,35-42,71H,1-14H3;12-31,33-40,67H,1-11H3;;;;/q4*-1;;;;/i;42D;6D3,7D3,8D3,23D,24D,27D,28D,31D,32D,39D;39D,40D;;;;.
What are the key properties of 2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum?
2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum has a molecular weight of 4502.54 g/mol, XLogP of 72.76, 39 rotatable bonds, 4 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[4-(4-phenylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-bis(2-deuteriopropan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;2-[1-[4-(4-tert-butylphenyl)-5-methyl-2-phenylphenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum is sourced from PubChem (CID 163691107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).