2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum

C258H236N15O5Pt5-5 — CID 157121238

IUPAC2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum
SMILESCc1cc(C)c(O)c(-c2nc3c(-c4[c-]c(-c5cc(-c6ccccc6)ccn5)cc(C(C)(C)C)c4)cccc3n2-c2ccc(-c3ccccc3)c(C(C)(C)C)c2)c1.Cc1ccc(-c2ccnc(-c3[c-]c(-c4cccc5c4nc(-c4cc(C)cc(C)c4O)n5-c4ccc(-c5ccccc5)c(C(C)(C)C)c4)cc(C(C)(C)C)c3)c2)cc1.[2H]C([2H])([2H])c1ccc(-c2ccnc(-c3[c-]c(-c4cccc5c4nc(-c4ccccc4O)n5-c4ccc(-c5ccccc5)c(C(C)(C)C)c4)cc(C(C)(C)C)c3)c2)cc1.[2H]c1c([2H])c(C([2H])([2H])[2H])c([2H])c([2H])c1-c1ccnc(-c2[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3ccc(-c4ccccc4)c(C(C)(C)C)c3)cc(C(C)(C)C)c2)c1.[2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3ccc(-c4ccccc4)c(C(C)(C)C)c3)cc(C(C)(C)C)c2)c([2H])c(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[Pt].[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C53H50N3O.C52H48N3O.3C51H46N3O.5Pt/c1-33-18-20-36(21-19-33)38-24-25-54-47(31-38)40-28-39(29-41(30-40)52(4,5)6)44-16-13-17-48-49(44)55-51(45-27-34(2)26-35(3)50(45)57)56(48)42-22-23-43(37-14-11-10-12-15-37)46(32-42)53(7,8)9;1-33-26-34(2)49(56)44(27-33)50-54-48-43(20-15-21-47(48)55(50)41-22-23-42(36-18-13-10-14-19-36)45(32-41)52(6,7)8)38-28-39(30-40(29-38)51(3,4)5)46-31-37(24-25-53-46)35-16-11-9-12-17-35;3*1-33-20-22-34(23-21-33)36-26-27-52-45(31-36)38-28-37(29-39(30-38)50(2,3)4)42-17-13-18-46-48(42)53-49(43-16-11-12-19-47(43)55)54(46)40-24-25-41(35-14-9-8-10-15-35)44(32-40)51(5,6)7;;;;;/h10-27,29-32,57H,1-9H3;9-27,29-32,56H,1-8H3;3*8-27,29-32,55H,1-7H3;;;;;/q5*-1;;;;;/i;;1D3,20D,21D,22D,23D,26D,27D,31D;1D3,20D,21D,22D,23D;1D3;;;;;
InChIKeyPVYJASFGRDNPTK-FMEMIOQZSA-N
MW4622.34 g/mol
LogP66.74
Rot. Bonds33

About 2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum

2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum (PubChem CID 157121238) has the molecular formula C258H236N15O5Pt5-5 and a molecular weight of 4622.34 g/mol. Its IUPAC name is 2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum.

Molecular Properties

Compound Name2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum
PubChem CID157121238
Molecular FormulaC258H236N15O5Pt5-5
Molecular Weight4622.34 g/mol
Exact Mass4618.82
IUPAC Name2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum
SMILESCc1cc(C)c(O)c(-c2nc3c(-c4[c-]c(-c5cc(-c6ccccc6)ccn5)cc(C(C)(C)C)c4)cccc3n2-c2ccc(-c3ccccc3)c(C(C)(C)C)c2)c1.Cc1ccc(-c2ccnc(-c3[c-]c(-c4cccc5c4nc(-c4cc(C)cc(C)c4O)n5-c4ccc(-c5ccccc5)c(C(C)(C)C)c4)cc(C(C)(C)C)c3)c2)cc1.[2H]C([2H])([2H])c1ccc(-c2ccnc(-c3[c-]c(-c4cccc5c4nc(-c4ccccc4O)n5-c4ccc(-c5ccccc5)c(C(C)(C)C)c4)cc(C(C)(C)C)c3)c2)cc1.[2H]c1c([2H])c(C([2H])([2H])[2H])c([2H])c([2H])c1-c1ccnc(-c2[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3ccc(-c4ccccc4)c(C(C)(C)C)c3)cc(C(C)(C)C)c2)c1.[2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3ccc(-c4ccccc4)c(C(C)(C)C)c3)cc(C(C)(C)C)c2)c([2H])c(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[Pt].[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C53H50N3O.C52H48N3O.3C51H46N3O.5Pt/c1-33-18-20-36(21-19-33)38-24-25-54-47(31-38)40-28-39(29-41(30-40)52(4,5)6)44-16-13-17-48-49(44)55-51(45-27-34(2)26-35(3)50(45)57)56(48)42-22-23-43(37-14-11-10-12-15-37)46(32-42)53(7,8)9;1-33-26-34(2)49(56)44(27-33)50-54-48-43(20-15-21-47(48)55(50)41-22-23-42(36-18-13-10-14-19-36)45(32-41)52(6,7)8)38-28-39(30-40(29-38)51(3,4)5)46-31-37(24-25-53-46)35-16-11-9-12-17-35;3*1-33-20-22-34(23-21-33)36-26-27-52-45(31-36)38-28-37(29-39(30-38)50(2,3)4)42-17-13-18-46-48(42)53-49(43-16-11-12-19-47(43)55)54(46)40-24-25-41(35-14-9-8-10-15-35)44(32-40)51(5,6)7;;;;;/h10-27,29-32,57H,1-9H3;9-27,29-32,56H,1-8H3;3*8-27,29-32,55H,1-7H3;;;;;/q5*-1;;;;;/i;;1D3,20D,21D,22D,23D,26D,27D,31D;1D3,20D,21D,22D,23D;1D3;;;;;
InChIKeyPVYJASFGRDNPTK-FMEMIOQZSA-N
XLogP66.74
TPSA254.70 Ų
H-Bond Donors5
H-Bond Acceptors20
Rotatable Bonds33
Heavy Atoms283
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004622.34
LogP ≤ 566.74
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1020

Analyze 2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum with MolForge

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Launch Full Analysis

Related Compounds

3-tert-butyl-N-[2-tert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-6-[10-(trifluoromethyl)benzo[g]quinazolin-4-yl]pyridin-2-amine;9-(4-tert-butyl-2-pyridinyl)-N-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]pyrido[2,3-b]indol-2-amine;2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[4-tert-butyl-6-[(4-phenyl-2-pyridinyl)amino]-2-pyridinyl]benzimidazol-2-yl]phenol;platinum;platinum(2+)
CID 157080983
CID 157462522
CID 157462522
CID 157617296
CID 157617296
CID 158157518
CID 158157518
CID 158239006
CID 158239006
CID 158431192
CID 158431192
Benzenesulfonyl-[2-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]azanide;5-fluoro-2-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenol;1-(3-phenyl-3a,7a-dihydroimidazo[4,5-b]pyridin-2-yl)naphthalen-2-ol;2-(3-phenylimidazo[4,5-b]pyridin-2-yl)pyren-1-ol;2-[3-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol;ZINC
CID 158578822
CID 158636196
CID 158636196
CID 159096807
CID 159096807
2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;7,7-dimethyl-1,11-dihydrobenzo[a]phenalene-1,11-diide;3-(2,6-dimethylphenyl)-8-methyl-4-aza-1-azoniapentacyclo[13.2.1.04,17.05,10.011,16]octadeca-1(17),2,5(10),6,8,11,13,15-octaene;N,N-diphenyl-6H-pyrido[2,1-a]isoindol-5-ium-2-amine;bis(4-hydroxypent-3-en-2-one);tris(iridium);5-methyl-2-phenylpyridine;1-phenylisoquinoline;platinum;2-[4-(trifluoromethyl)benzene-6-id-1-yl]quinoline
CID 159471047
CID 159570252
CID 159570252
CID 159810756
CID 159810756

Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum?
The IUPAC name of 2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum (CID 157121238) is 2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum.
What is the SMILES notation for 2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum?
The canonical SMILES for 2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum is Cc1cc(C)c(O)c(-c2nc3c(-c4[c-]c(-c5cc(-c6ccccc6)ccn5)cc(C(C)(C)C)c4)cccc3n2-c2ccc(-c3ccccc3)c(C(C)(C)C)c2)c1.Cc1ccc(-c2ccnc(-c3[c-]c(-c4cccc5c4nc(-c4cc(C)cc(C)c4O)n5-c4ccc(-c5ccccc5)c(C(C)(C)C)c4)cc(C(C)(C)C)c3)c2)cc1.[2H]C([2H])([2H])c1ccc(-c2ccnc(-c3[c-]c(-c4cccc5c4nc(-c4ccccc4O)n5-c4ccc(-c5ccccc5)c(C(C)(C)C)c4)cc(C(C)(C)C)c3)c2)cc1.[2H]c1c([2H])c(C([2H])([2H])[2H])c([2H])c([2H])c1-c1ccnc(-c2[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3ccc(-c4ccccc4)c(C(C)(C)C)c3)cc(C(C)(C)C)c2)c1.[2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3ccc(-c4ccccc4)c(C(C)(C)C)c3)cc(C(C)(C)C)c2)c([2H])c(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[Pt].[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of 2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum?
The InChIKey is PVYJASFGRDNPTK-FMEMIOQZSA-N. The full InChI is InChI=1S/C53H50N3O.C52H48N3O.3C51H46N3O.5Pt/c1-33-18-20-36(21-19-33)38-24-25-54-47(31-38)40-28-39(29-41(30-40)52(4,5)6)44-16-13-17-48-49(44)55-51(45-27-34(2)26-35(3)50(45)57)56(48)42-22-23-43(37-14-11-10-12-15-37)46(32-42)53(7,8)9;1-33-26-34(2)49(56)44(27-33)50-54-48-43(20-15-21-47(48)55(50)41-22-23-42(36-18-13-10-14-19-36)45(32-41)52(6,7)8)38-28-39(30-40(29-38)51(3,4)5)46-31-37(24-25-53-46)35-16-11-9-12-17-35;3*1-33-20-22-34(23-21-33)36-26-27-52-45(31-36)38-28-37(29-39(30-38)50(2,3)4)42-17-13-18-46-48(42)53-49(43-16-11-12-19-47(43)55)54(46)40-24-25-41(35-14-9-8-10-15-35)44(32-40)51(5,6)7;;;;;/h10-27,29-32,57H,1-9H3;9-27,29-32,56H,1-8H3;3*8-27,29-32,55H,1-7H3;;;;;/q5*-1;;;;;/i;;1D3,20D,21D,22D,23D,26D,27D,31D;1D3,20D,21D,22D,23D;1D3;;;;;.
What are the key properties of 2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum?
2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum has a molecular weight of 4622.34 g/mol, XLogP of 66.74, 33 rotatable bonds, 5 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(3-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-dimethylphenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[4-[4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum is sourced from PubChem (CID 157121238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).