2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum

C202H212N12O5Pt4S-4 — CID 160704645

IUPAC2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum
SMILESCC(C)c1cc(-c2cc3ccccc3cn2)[c-]c(-c2cccc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2c(C(C)C)cccc2C(C)C)c1.CC(C)c1cc(-c2ccc3ccccc3n2)[c-]c(-c2cccc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2c(C(C)C)cccc2C(C)C)c1.CC(C)c1cccc(C(C)C)c1-n1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)nc2c(-c3[c-]c(-c4ccccn4)c4c(c3)oc3ccccc34)cccc21.CC(C)c1cccc(C(C)C)c1-n1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)nc2c(-c3[c-]c(-c4ccccn4)c4c(c3)sc3ccccc34)cccc21.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/2C51H56N3O.C50H50N3O2.C50H50N3OS.4Pt/c1-30(2)34-25-35(27-36(26-34)44-24-23-33-17-13-14-21-43(33)52-44)40-20-16-22-45-46(40)53-49(54(45)47-38(31(3)4)18-15-19-39(47)32(5)6)41-28-37(50(7,8)9)29-42(48(41)55)51(10,11)12;1-30(2)35-23-36(25-37(24-35)44-26-33-17-13-14-18-34(33)29-52-44)41-21-16-22-45-46(41)53-49(54(45)47-39(31(3)4)19-15-20-40(47)32(5)6)42-27-38(50(7,8)9)28-43(48(42)55)51(10,11)12;2*1-29(2)33-18-15-19-34(30(3)4)46(33)53-41-22-16-20-35(45(41)52-48(53)38-27-32(49(5,6)7)28-39(47(38)54)50(8,9)10)31-25-37(40-21-13-14-24-51-40)44-36-17-11-12-23-42(36)55-43(44)26-31;;;;/h13-26,28-32,55H,1-12H3;13-24,26-32,55H,1-12H3;2*11-24,26-30,54H,1-10H3;;;;/q4*-1;;;;
InChIKeyJOZYUYDKOIPQQU-UHFFFAOYSA-N
MW3700.38 g/mol
LogP55.89
Rot. Bonds26

About 2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum

2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum (PubChem CID 160704645) has the molecular formula C202H212N12O5Pt4S-4 and a molecular weight of 3700.38 g/mol. Its IUPAC name is 2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum.

Molecular Properties

Compound Name2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum
PubChem CID160704645
Molecular FormulaC202H212N12O5Pt4S-4
Molecular Weight3700.38 g/mol
Exact Mass3697.50
IUPAC Name2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum
SMILESCC(C)c1cc(-c2cc3ccccc3cn2)[c-]c(-c2cccc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2c(C(C)C)cccc2C(C)C)c1.CC(C)c1cc(-c2ccc3ccccc3n2)[c-]c(-c2cccc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2c(C(C)C)cccc2C(C)C)c1.CC(C)c1cccc(C(C)C)c1-n1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)nc2c(-c3[c-]c(-c4ccccn4)c4c(c3)oc3ccccc34)cccc21.CC(C)c1cccc(C(C)C)c1-n1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)nc2c(-c3[c-]c(-c4ccccn4)c4c(c3)sc3ccccc34)cccc21.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/2C51H56N3O.C50H50N3O2.C50H50N3OS.4Pt/c1-30(2)34-25-35(27-36(26-34)44-24-23-33-17-13-14-21-43(33)52-44)40-20-16-22-45-46(40)53-49(54(45)47-38(31(3)4)18-15-19-39(47)32(5)6)41-28-37(50(7,8)9)29-42(48(41)55)51(10,11)12;1-30(2)35-23-36(25-37(24-35)44-26-33-17-13-14-18-34(33)29-52-44)41-21-16-22-45-46(41)53-49(54(45)47-39(31(3)4)19-15-20-40(47)32(5)6)42-27-38(50(7,8)9)28-43(48(42)55)51(10,11)12;2*1-29(2)33-18-15-19-34(30(3)4)46(33)53-41-22-16-20-35(45(41)52-48(53)38-27-32(49(5,6)7)28-39(47(38)54)50(8,9)10)31-25-37(40-21-13-14-24-51-40)44-36-17-11-12-23-42(36)55-43(44)26-31;;;;/h13-26,28-32,55H,1-12H3;13-24,26-32,55H,1-12H3;2*11-24,26-30,54H,1-10H3;;;;/q4*-1;;;;
InChIKeyJOZYUYDKOIPQQU-UHFFFAOYSA-N
XLogP55.89
TPSA216.90 Ų
H-Bond Donors4
H-Bond Acceptors18
Rotatable Bonds26
Heavy Atoms224
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003700.38
LogP ≤ 555.89
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

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

Analyze 2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum?
The IUPAC name of 2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum (CID 160704645) is 2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum.
What is the SMILES notation for 2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum?
The canonical SMILES for 2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum is CC(C)c1cc(-c2cc3ccccc3cn2)[c-]c(-c2cccc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2c(C(C)C)cccc2C(C)C)c1.CC(C)c1cc(-c2ccc3ccccc3n2)[c-]c(-c2cccc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2c(C(C)C)cccc2C(C)C)c1.CC(C)c1cccc(C(C)C)c1-n1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)nc2c(-c3[c-]c(-c4ccccn4)c4c(c3)oc3ccccc34)cccc21.CC(C)c1cccc(C(C)C)c1-n1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)nc2c(-c3[c-]c(-c4ccccn4)c4c(c3)sc3ccccc34)cccc21.[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of 2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum?
The InChIKey is JOZYUYDKOIPQQU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C51H56N3O.C50H50N3O2.C50H50N3OS.4Pt/c1-30(2)34-25-35(27-36(26-34)44-24-23-33-17-13-14-21-43(33)52-44)40-20-16-22-45-46(40)53-49(54(45)47-38(31(3)4)18-15-19-39(47)32(5)6)41-28-37(50(7,8)9)29-42(48(41)55)51(10,11)12;1-30(2)35-23-36(25-37(24-35)44-26-33-17-13-14-18-34(33)29-52-44)41-21-16-22-45-46(41)53-49(54(45)47-39(31(3)4)19-15-20-40(47)32(5)6)42-27-38(50(7,8)9)28-43(48(42)55)51(10,11)12;2*1-29(2)33-18-15-19-34(30(3)4)46(33)53-41-22-16-20-35(45(41)52-48(53)38-27-32(49(5,6)7)28-39(47(38)54)50(8,9)10)31-25-37(40-21-13-14-24-51-40)44-36-17-11-12-23-42(36)55-43(44)26-31;;;;/h13-26,28-32,55H,1-12H3;13-24,26-32,55H,1-12H3;2*11-24,26-30,54H,1-10H3;;;;/q4*-1;;;;.
What are the key properties of 2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum?
2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum has a molecular weight of 3700.38 g/mol, XLogP of 55.89, 26 rotatable bonds, 4 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-isoquinolin-3-yl-5-propan-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(3-propan-2-yl-5-quinolin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzofuran-2-id-3-yl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-[2,6-di(propan-2-yl)phenyl]-4-(1-pyridin-2-yl-2H-dibenzothiophen-2-id-3-yl)benzimidazol-2-yl]phenol;platinum is sourced from PubChem (CID 160704645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).