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

C181H170N12O4Pt4-4 — CID 159827171

IUPAC2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-1-phenyl-4-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-[3,5-di(propan-2-yl)phenyl]-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum
SMILESCC(C)c1cc(-c2cc(-c3cc(C(C)(C)C)ccn3)[c-]c(-c3cc(C(C)(C)C)cc4c3nc(-c3ccccc3O)n4-c3ccccc3)c2)cc(C(C)C)c1.CC(C)c1cc(-c2cc(-c3cc(C(C)(C)C)ccn3)[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3ccccc3)c2)cc(C(C)C)c1.CC(C)c1cc(-c2cc(-c3ccccn3)[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3ccccc3)c2)cc(C(C)C)c1.Cc1cc(C)c(-c2cc(-c3ccccn3)[c-]c(-c3cc(C(C)(C)C)cc4c3nc(-c3ccccc3O)n4-c3ccccc3)c2)c(C)c1.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C50H52N3O.C46H44N3O.C43H38N3O.C42H36N3O.4Pt/c1-31(2)33-22-34(32(3)4)24-35(23-33)36-25-37(27-38(26-36)44-29-39(20-21-51-44)49(5,6)7)43-28-40(50(8,9)10)30-45-47(43)52-48(42-18-14-15-19-46(42)54)53(45)41-16-12-11-13-17-41;1-29(2)31-22-32(30(3)4)24-33(23-31)34-25-35(27-36(26-34)41-28-37(20-21-47-41)46(5,6)7)39-17-13-18-42-44(39)48-45(40-16-11-12-19-43(40)50)49(42)38-14-9-8-10-15-38;1-27-20-28(2)40(29(3)21-27)32-23-30(22-31(24-32)37-17-12-13-19-44-37)36-25-33(43(4,5)6)26-38-41(36)45-42(35-16-10-11-18-39(35)47)46(38)34-14-8-7-9-15-34;1-27(2)29-21-30(28(3)4)23-31(22-29)32-24-33(26-34(25-32)38-17-10-11-20-43-38)36-16-12-18-39-41(36)44-42(37-15-8-9-19-40(37)46)45(39)35-13-6-5-7-14-35;;;;/h11-26,28-32,54H,1-10H3;8-26,28-30,50H,1-7H3;7-21,23-26,47H,1-6H3;5-25,27-28,46H,1-4H3;;;;/q4*-1;;;;
InChIKeyFUEIJQTZMULHTE-UHFFFAOYSA-N
MW3357.74 g/mol
LogP47.22
Rot. Bonds26

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

2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-1-phenyl-4-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-[3,5-di(propan-2-yl)phenyl]-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum (PubChem CID 159827171) has the molecular formula C181H170N12O4Pt4-4 and a molecular weight of 3357.74 g/mol. Its IUPAC name is 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-1-phenyl-4-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-[3,5-di(propan-2-yl)phenyl]-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum.

Molecular Properties

Compound Name2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-1-phenyl-4-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-[3,5-di(propan-2-yl)phenyl]-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum
PubChem CID159827171
Molecular FormulaC181H170N12O4Pt4-4
Molecular Weight3357.74 g/mol
Exact Mass3355.21
IUPAC Name2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-1-phenyl-4-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-[3,5-di(propan-2-yl)phenyl]-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum
SMILESCC(C)c1cc(-c2cc(-c3cc(C(C)(C)C)ccn3)[c-]c(-c3cc(C(C)(C)C)cc4c3nc(-c3ccccc3O)n4-c3ccccc3)c2)cc(C(C)C)c1.CC(C)c1cc(-c2cc(-c3cc(C(C)(C)C)ccn3)[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3ccccc3)c2)cc(C(C)C)c1.CC(C)c1cc(-c2cc(-c3ccccn3)[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3ccccc3)c2)cc(C(C)C)c1.Cc1cc(C)c(-c2cc(-c3ccccn3)[c-]c(-c3cc(C(C)(C)C)cc4c3nc(-c3ccccc3O)n4-c3ccccc3)c2)c(C)c1.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C50H52N3O.C46H44N3O.C43H38N3O.C42H36N3O.4Pt/c1-31(2)33-22-34(32(3)4)24-35(23-33)36-25-37(27-38(26-36)44-29-39(20-21-51-44)49(5,6)7)43-28-40(50(8,9)10)30-45-47(43)52-48(42-18-14-15-19-46(42)54)53(45)41-16-12-11-13-17-41;1-29(2)31-22-32(30(3)4)24-33(23-31)34-25-35(27-36(26-34)41-28-37(20-21-47-41)46(5,6)7)39-17-13-18-42-44(39)48-45(40-16-11-12-19-43(40)50)49(42)38-14-9-8-10-15-38;1-27-20-28(2)40(29(3)21-27)32-23-30(22-31(24-32)37-17-12-13-19-44-37)36-25-33(43(4,5)6)26-38-41(36)45-42(35-16-10-11-18-39(35)47)46(38)34-14-8-7-9-15-34;1-27(2)29-21-30(28(3)4)23-31(22-29)32-24-33(26-34(25-32)38-17-10-11-20-43-38)36-16-12-18-39-41(36)44-42(37-15-8-9-19-40(37)46)45(39)35-13-6-5-7-14-35;;;;/h11-26,28-32,54H,1-10H3;8-26,28-30,50H,1-7H3;7-21,23-26,47H,1-6H3;5-25,27-28,46H,1-4H3;;;;/q4*-1;;;;
InChIKeyFUEIJQTZMULHTE-UHFFFAOYSA-N
XLogP47.22
TPSA203.76 Ų
H-Bond Donors4
H-Bond Acceptors16
Rotatable Bonds26
Heavy Atoms201
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003357.74
LogP ≤ 547.22
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-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-1-phenyl-4-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-[3,5-di(propan-2-yl)phenyl]-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-1-phenyl-4-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-[3,5-di(propan-2-yl)phenyl]-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum?
The IUPAC name of 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-1-phenyl-4-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-[3,5-di(propan-2-yl)phenyl]-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum (CID 159827171) is 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-1-phenyl-4-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-[3,5-di(propan-2-yl)phenyl]-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum.
What is the SMILES notation for 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-1-phenyl-4-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-[3,5-di(propan-2-yl)phenyl]-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum?
The canonical SMILES for 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-1-phenyl-4-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-[3,5-di(propan-2-yl)phenyl]-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum is CC(C)c1cc(-c2cc(-c3cc(C(C)(C)C)ccn3)[c-]c(-c3cc(C(C)(C)C)cc4c3nc(-c3ccccc3O)n4-c3ccccc3)c2)cc(C(C)C)c1.CC(C)c1cc(-c2cc(-c3cc(C(C)(C)C)ccn3)[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3ccccc3)c2)cc(C(C)C)c1.CC(C)c1cc(-c2cc(-c3ccccn3)[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3ccccc3)c2)cc(C(C)C)c1.Cc1cc(C)c(-c2cc(-c3ccccn3)[c-]c(-c3cc(C(C)(C)C)cc4c3nc(-c3ccccc3O)n4-c3ccccc3)c2)c(C)c1.[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-1-phenyl-4-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-[3,5-di(propan-2-yl)phenyl]-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum?
The InChIKey is FUEIJQTZMULHTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H52N3O.C46H44N3O.C43H38N3O.C42H36N3O.4Pt/c1-31(2)33-22-34(32(3)4)24-35(23-33)36-25-37(27-38(26-36)44-29-39(20-21-51-44)49(5,6)7)43-28-40(50(8,9)10)30-45-47(43)52-48(42-18-14-15-19-46(42)54)53(45)41-16-12-11-13-17-41;1-29(2)31-22-32(30(3)4)24-33(23-31)34-25-35(27-36(26-34)41-28-37(20-21-47-41)46(5,6)7)39-17-13-18-42-44(39)48-45(40-16-11-12-19-43(40)50)49(42)38-14-9-8-10-15-38;1-27-20-28(2)40(29(3)21-27)32-23-30(22-31(24-32)37-17-12-13-19-44-37)36-25-33(43(4,5)6)26-38-41(36)45-42(35-16-10-11-18-39(35)47)46(38)34-14-8-7-9-15-34;1-27(2)29-21-30(28(3)4)23-31(22-29)32-24-33(26-34(25-32)38-17-10-11-20-43-38)36-16-12-18-39-41(36)44-42(37-15-8-9-19-40(37)46)45(39)35-13-6-5-7-14-35;;;;/h11-26,28-32,54H,1-10H3;8-26,28-30,50H,1-7H3;7-21,23-26,47H,1-6H3;5-25,27-28,46H,1-4H3;;;;/q4*-1;;;;.
What are the key properties of 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-1-phenyl-4-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-[3,5-di(propan-2-yl)phenyl]-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum?
2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-1-phenyl-4-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-[3,5-di(propan-2-yl)phenyl]-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum has a molecular weight of 3357.74 g/mol, XLogP of 47.22, 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-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-1-phenyl-4-[3-pyridin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-[3,5-di(propan-2-yl)phenyl]-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum is sourced from PubChem (CID 159827171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).