2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum

C193H194N12O4Pt4-4 — CID 159835047

IUPAC2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum
SMILESCC(C)c1cccc(C(C)C)c1-n1c(-c2cc(-c3ccccc3)ccc2O)nc2c(-c3[c-]c(-c4cc(C(C)(C)C)ccn4)c(C(C)(C)C)cc3C(C)(C)C)cccc21.CC(C)c1cccc(C(C)C)c1-n1c(-c2cc(-c3ccccc3)ccc2O)nc2c(-c3[c-]c(-c4ccccn4)c(C(C)(C)C)cc3C(C)(C)C)cc(C(C)(C)C)cc21.CC(C)c1cccc(C(C)C)c1-n1c(-c2cc(-c3ccccc3)ccc2O)nc2c(-c3[c-]c(-c4ccccn4)ccc3)cccc21.Cc1cc(C)c(-n2c(-c3cc(-c4ccccc4)ccc3O)nc3c(-c4[c-]c(-c5ccccn5)ccc4)cc(C(C)(C)C)cc32)c(C)c1.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/2C54H60N3O.C43H38N3O.C42H36N3O.4Pt/c1-33(2)38-21-17-22-39(34(3)4)50(38)57-47-24-18-23-40(49(47)56-51(57)43-29-36(25-26-48(43)58)35-19-15-14-16-20-35)41-31-42(46-30-37(27-28-55-46)52(5,6)7)45(54(11,12)13)32-44(41)53(8,9)10;1-33(2)38-22-19-23-39(34(3)4)50(38)57-47-30-37(52(5,6)7)29-41(49(47)56-51(57)43-28-36(25-26-48(43)58)35-20-15-14-16-21-35)40-31-42(46-24-17-18-27-55-46)45(54(11,12)13)32-44(40)53(8,9)10;1-27-21-28(2)41(29(3)22-27)46-38-26-34(43(4,5)6)25-35(32-15-12-16-33(23-32)37-17-10-11-20-44-37)40(38)45-42(46)36-24-31(18-19-39(36)47)30-13-8-7-9-14-30;1-27(2)33-17-11-18-34(28(3)4)41(33)45-38-21-12-19-35(31-15-10-16-32(25-31)37-20-8-9-24-43-37)40(38)44-42(45)36-26-30(22-23-39(36)46)29-13-6-5-7-14-29;;;;/h2*14-30,32-34,58H,1-13H3;7-22,24-26,47H,1-6H3;5-24,26-28,46H,1-4H3;;;;/q4*-1;;;;
InChIKeyNQXNAMKYHGYQLZ-UHFFFAOYSA-N
MW3526.07 g/mol
LogP51.12
Rot. Bonds26

About 2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum

2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum (PubChem CID 159835047) has the molecular formula C193H194N12O4Pt4-4 and a molecular weight of 3526.07 g/mol. Its IUPAC name is 2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum.

Molecular Properties

Compound Name2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum
PubChem CID159835047
Molecular FormulaC193H194N12O4Pt4-4
Molecular Weight3526.07 g/mol
Exact Mass3523.40
IUPAC Name2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum
SMILESCC(C)c1cccc(C(C)C)c1-n1c(-c2cc(-c3ccccc3)ccc2O)nc2c(-c3[c-]c(-c4cc(C(C)(C)C)ccn4)c(C(C)(C)C)cc3C(C)(C)C)cccc21.CC(C)c1cccc(C(C)C)c1-n1c(-c2cc(-c3ccccc3)ccc2O)nc2c(-c3[c-]c(-c4ccccn4)c(C(C)(C)C)cc3C(C)(C)C)cc(C(C)(C)C)cc21.CC(C)c1cccc(C(C)C)c1-n1c(-c2cc(-c3ccccc3)ccc2O)nc2c(-c3[c-]c(-c4ccccn4)ccc3)cccc21.Cc1cc(C)c(-n2c(-c3cc(-c4ccccc4)ccc3O)nc3c(-c4[c-]c(-c5ccccn5)ccc4)cc(C(C)(C)C)cc32)c(C)c1.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/2C54H60N3O.C43H38N3O.C42H36N3O.4Pt/c1-33(2)38-21-17-22-39(34(3)4)50(38)57-47-24-18-23-40(49(47)56-51(57)43-29-36(25-26-48(43)58)35-19-15-14-16-20-35)41-31-42(46-30-37(27-28-55-46)52(5,6)7)45(54(11,12)13)32-44(41)53(8,9)10;1-33(2)38-22-19-23-39(34(3)4)50(38)57-47-30-37(52(5,6)7)29-41(49(47)56-51(57)43-28-36(25-26-48(43)58)35-20-15-14-16-21-35)40-31-42(46-24-17-18-27-55-46)45(54(11,12)13)32-44(40)53(8,9)10;1-27-21-28(2)41(29(3)22-27)46-38-26-34(43(4,5)6)25-35(32-15-12-16-33(23-32)37-17-10-11-20-44-37)40(38)45-42(46)36-24-31(18-19-39(36)47)30-13-8-7-9-14-30;1-27(2)33-17-11-18-34(28(3)4)41(33)45-38-21-12-19-35(31-15-10-16-32(25-31)37-20-8-9-24-43-37)40(38)44-42(45)36-26-30(22-23-39(36)46)29-13-6-5-7-14-29;;;;/h2*14-30,32-34,58H,1-13H3;7-22,24-26,47H,1-6H3;5-24,26-28,46H,1-4H3;;;;/q4*-1;;;;
InChIKeyNQXNAMKYHGYQLZ-UHFFFAOYSA-N
XLogP51.12
TPSA203.76 Ų
H-Bond Donors4
H-Bond Acceptors16
Rotatable Bonds26
Heavy Atoms213
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003526.07
LogP ≤ 551.12
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

Analyze 2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum?
The IUPAC name of 2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum (CID 159835047) is 2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum.
What is the SMILES notation for 2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum?
The canonical SMILES for 2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum is CC(C)c1cccc(C(C)C)c1-n1c(-c2cc(-c3ccccc3)ccc2O)nc2c(-c3[c-]c(-c4cc(C(C)(C)C)ccn4)c(C(C)(C)C)cc3C(C)(C)C)cccc21.CC(C)c1cccc(C(C)C)c1-n1c(-c2cc(-c3ccccc3)ccc2O)nc2c(-c3[c-]c(-c4ccccn4)c(C(C)(C)C)cc3C(C)(C)C)cc(C(C)(C)C)cc21.CC(C)c1cccc(C(C)C)c1-n1c(-c2cc(-c3ccccc3)ccc2O)nc2c(-c3[c-]c(-c4ccccn4)ccc3)cccc21.Cc1cc(C)c(-n2c(-c3cc(-c4ccccc4)ccc3O)nc3c(-c4[c-]c(-c5ccccn5)ccc4)cc(C(C)(C)C)cc32)c(C)c1.[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of 2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum?
The InChIKey is NQXNAMKYHGYQLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C54H60N3O.C43H38N3O.C42H36N3O.4Pt/c1-33(2)38-21-17-22-39(34(3)4)50(38)57-47-24-18-23-40(49(47)56-51(57)43-29-36(25-26-48(43)58)35-19-15-14-16-20-35)41-31-42(46-30-37(27-28-55-46)52(5,6)7)45(54(11,12)13)32-44(41)53(8,9)10;1-33(2)38-22-19-23-39(34(3)4)50(38)57-47-30-37(52(5,6)7)29-41(49(47)56-51(57)43-28-36(25-26-48(43)58)35-20-15-14-16-21-35)40-31-42(46-24-17-18-27-55-46)45(54(11,12)13)32-44(40)53(8,9)10;1-27-21-28(2)41(29(3)22-27)46-38-26-34(43(4,5)6)25-35(32-15-12-16-33(23-32)37-17-10-11-20-44-37)40(38)45-42(46)36-24-31(18-19-39(36)47)30-13-8-7-9-14-30;1-27(2)33-17-11-18-34(28(3)4)41(33)45-38-21-12-19-35(31-15-10-16-32(25-31)37-20-8-9-24-43-37)40(38)44-42(45)36-26-30(22-23-39(36)46)29-13-6-5-7-14-29;;;;/h2*14-30,32-34,58H,1-13H3;7-22,24-26,47H,1-6H3;5-24,26-28,46H,1-4H3;;;;/q4*-1;;;;.
What are the key properties of 2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum?
2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum has a molecular weight of 3526.07 g/mol, XLogP of 51.12, 26 rotatable bonds, 4 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-tert-butyl-4-(2,4-ditert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-4-phenylphenol;2-[4-[2,4-ditert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-4-phenylphenol;2-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]-4-phenylphenol;platinum is sourced from PubChem (CID 159835047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).