1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane

C323H302Ir5N16O3S2Si5-10 — CID 160735945

IUPAC1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane
SMILESCC(C)Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(C)c1cc(-c2ccccc2)cc(C(C)C)c1-n1c(-c2[c-]ccc3c2oc2ccc(-c4ccccc4-c4ccccc4)cc23)nc2ccccc21.CC(C)c1cc(-c2ccccc2)cc(C(C)C)c1-n1c(-c2[c-]ccc3c2sc2ccc(-c4ccc(-c5ccccc5)cc4)cc23)nc2ccccc21.Cc1cc(C)cc(-c2cccc(-c3ccc4sc5c(-c6nc7ccccc7n6-c6c(C(C)C)cc(C(C)(C)C)cc6C(C)C)[c-]ccc5c4c3)c2)c1.[2H]C(C)(C)c1cc(-c2[c-]cc3ccccc3c2)ncc1[Si](C)(C)C.[2H]C([2H])([2H])c1c[c-]c(-c2cc(C([2H])([2H])C(C)(C)C)c([Si](C)(C)C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc([Si](C)(C)C)cn2)cc1.[2H]C([2H])([2H])c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.[2H]C([2H])([2H])c1nc(C)cc2nc(-c3[c-]ccc4c3oc3ccc(-c5ccc(-c6ccccc6)cc5)cc34)n(-c3c(C(C)C)cccc3C(C)C)c12.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccc2c(oc3ccc(-c4ccc(-c5ccccc5)cc4)cc32)c1-c1nc2ccccc2n1-c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C49H39N2O.C49H39N2S.C49H47N2S.C44H38N3O.C43H27N2O.C21H24NSi.C20H28NSi.C18H24NSi.2C15H18NSi.5Ir/c1-31(2)41-29-36(33-16-7-5-8-17-33)30-42(32(3)4)47(41)51-45-25-14-13-24-44(45)50-49(51)40-23-15-22-39-43-28-35(26-27-46(43)52-48(39)40)38-21-12-11-20-37(38)34-18-9-6-10-19-34;1-31(2)41-29-38(34-16-9-6-10-17-34)30-42(32(3)4)47(41)51-45-21-12-11-20-44(45)50-49(51)40-19-13-18-39-43-28-37(26-27-46(43)52-48(39)40)36-24-22-35(23-25-36)33-14-7-5-8-15-33;1-29(2)40-27-37(49(7,8)9)28-41(30(3)4)46(40)51-44-19-11-10-18-43(44)50-48(51)39-17-13-16-38-42-26-35(20-21-45(42)52-47(38)39)33-14-12-15-34(25-33)36-23-31(5)22-32(6)24-36;1-26(2)34-14-10-15-35(27(3)4)42(34)47-41-29(6)45-28(5)24-39(41)46-44(47)37-17-11-16-36-38-25-33(22-23-40(38)48-43(36)37)32-20-18-31(19-21-32)30-12-8-7-9-13-30;1-3-10-29(11-4-1)31-18-20-33(21-19-31)34-24-27-41-38(28-34)36-14-9-15-37(42(36)46-41)43-44-39-16-7-8-17-40(39)45(43)35-25-22-32(23-26-35)30-12-5-2-6-13-30;1-15(2)19-13-20(22-14-21(19)23(3,4)5)18-11-10-16-8-6-7-9-17(16)12-18;1-15-8-10-16(11-9-15)18-12-17(13-20(2,3)4)19(14-21-18)22(5,6)7;1-14(2)11-16-12-17(15-9-7-6-8-10-15)19-13-18(16)20(3,4)5;1-12-5-7-13(8-6-12)15-10-9-14(11-16-15)17(2,3)4;1-12-10-14(13-8-6-5-7-9-13)16-11-15(12)17(2,3)4;;;;;/h5-22,24-32H,1-4H3;5-18,20-32H,1-4H3;10-16,18-30H,1-9H3;7-16,18-27H,1-6H3;1-14,16-28H;6-10,12-15H,1-5H3;8-10,12,14H,13H2,1-7H3;6-9,12-14H,11H2,1-5H3;5-7,9-11H,1-4H3;5-8,10-11H,1-4H3;;;;;/q10*-1;;;;;/i;;;6D3;;15D;1D3,13D2;;2*1D3;;;;;
InChIKeyCSFVZQIMQHQVKE-IOZMIBHLSA-N
MW5636.82 g/mol
LogP86.93
Rot. Bonds49

About 1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane

1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane (PubChem CID 160735945) has the molecular formula C323H302Ir5N16O3S2Si5-10 and a molecular weight of 5636.82 g/mol. Its IUPAC name is 1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane.

Molecular Properties

Compound Name1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane
PubChem CID160735945
Molecular FormulaC323H302Ir5N16O3S2Si5-10
Molecular Weight5636.82 g/mol
Exact Mass5636.14
IUPAC Name1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane
SMILESCC(C)Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(C)c1cc(-c2ccccc2)cc(C(C)C)c1-n1c(-c2[c-]ccc3c2oc2ccc(-c4ccccc4-c4ccccc4)cc23)nc2ccccc21.CC(C)c1cc(-c2ccccc2)cc(C(C)C)c1-n1c(-c2[c-]ccc3c2sc2ccc(-c4ccc(-c5ccccc5)cc4)cc23)nc2ccccc21.Cc1cc(C)cc(-c2cccc(-c3ccc4sc5c(-c6nc7ccccc7n6-c6c(C(C)C)cc(C(C)(C)C)cc6C(C)C)[c-]ccc5c4c3)c2)c1.[2H]C(C)(C)c1cc(-c2[c-]cc3ccccc3c2)ncc1[Si](C)(C)C.[2H]C([2H])([2H])c1c[c-]c(-c2cc(C([2H])([2H])C(C)(C)C)c([Si](C)(C)C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc([Si](C)(C)C)cn2)cc1.[2H]C([2H])([2H])c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.[2H]C([2H])([2H])c1nc(C)cc2nc(-c3[c-]ccc4c3oc3ccc(-c5ccc(-c6ccccc6)cc5)cc34)n(-c3c(C(C)C)cccc3C(C)C)c12.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccc2c(oc3ccc(-c4ccc(-c5ccccc5)cc4)cc32)c1-c1nc2ccccc2n1-c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C49H39N2O.C49H39N2S.C49H47N2S.C44H38N3O.C43H27N2O.C21H24NSi.C20H28NSi.C18H24NSi.2C15H18NSi.5Ir/c1-31(2)41-29-36(33-16-7-5-8-17-33)30-42(32(3)4)47(41)51-45-25-14-13-24-44(45)50-49(51)40-23-15-22-39-43-28-35(26-27-46(43)52-48(39)40)38-21-12-11-20-37(38)34-18-9-6-10-19-34;1-31(2)41-29-38(34-16-9-6-10-17-34)30-42(32(3)4)47(41)51-45-21-12-11-20-44(45)50-49(51)40-19-13-18-39-43-28-37(26-27-46(43)52-48(39)40)36-24-22-35(23-25-36)33-14-7-5-8-15-33;1-29(2)40-27-37(49(7,8)9)28-41(30(3)4)46(40)51-44-19-11-10-18-43(44)50-48(51)39-17-13-16-38-42-26-35(20-21-45(42)52-47(38)39)33-14-12-15-34(25-33)36-23-31(5)22-32(6)24-36;1-26(2)34-14-10-15-35(27(3)4)42(34)47-41-29(6)45-28(5)24-39(41)46-44(47)37-17-11-16-36-38-25-33(22-23-40(38)48-43(36)37)32-20-18-31(19-21-32)30-12-8-7-9-13-30;1-3-10-29(11-4-1)31-18-20-33(21-19-31)34-24-27-41-38(28-34)36-14-9-15-37(42(36)46-41)43-44-39-16-7-8-17-40(39)45(43)35-25-22-32(23-26-35)30-12-5-2-6-13-30;1-15(2)19-13-20(22-14-21(19)23(3,4)5)18-11-10-16-8-6-7-9-17(16)12-18;1-15-8-10-16(11-9-15)18-12-17(13-20(2,3)4)19(14-21-18)22(5,6)7;1-14(2)11-16-12-17(15-9-7-6-8-10-15)19-13-18(16)20(3,4)5;1-12-5-7-13(8-6-12)15-10-9-14(11-16-15)17(2,3)4;1-12-10-14(13-8-6-5-7-9-13)16-11-15(12)17(2,3)4;;;;;/h5-22,24-32H,1-4H3;5-18,20-32H,1-4H3;10-16,18-30H,1-9H3;7-16,18-27H,1-6H3;1-14,16-28H;6-10,12-15H,1-5H3;8-10,12,14H,13H2,1-7H3;6-9,12-14H,11H2,1-5H3;5-7,9-11H,1-4H3;5-8,10-11H,1-4H3;;;;;/q10*-1;;;;;/i;;;6D3;;15D;1D3,13D2;;2*1D3;;;;;
InChIKeyCSFVZQIMQHQVKE-IOZMIBHLSA-N
XLogP86.93
TPSA205.86 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds49
Heavy Atoms354
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005636.82
LogP ≤ 586.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Analyze 1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane with MolForge

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Launch Full Analysis

Related Compounds

[4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2-methylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2-methylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tris(2-(7-phenyl-3H-dibenzofuran-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-(7-pyridin-4-yl-3H-dibenzofuran-3-id-4-yl)benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane
CID 163870429
[4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;iridium;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[7-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole
CID 156657300
[6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;pentakis(2-(3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;pentakis(iridium);trimethyl-[4-(2-methylpropyl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]germane
CID 159845747
1-(2,6-diphenylphenyl)-2-[7-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium;trimethyl-[4-(2-methylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane
CID 167331851
iridium;1-[4-methyl-2,6-di(propan-2-yl)phenyl]-2-[7-(3-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;trimethyl-[4-(trideuteriomethyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane
CID 156660902
[4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;2-(3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;iridium
CID 156660834
1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-(3-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]-trimethylsilane;iridium
CID 156658912
[4-(1,1-dideuterio-2-methylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;iridium;2-(7-methyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole
CID 156660815
[6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylsilane;iridium;2-(7-methyl-3H-dibenzofuran-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole
CID 156658523
[4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;2-(3H-dibenzothiophen-3-id-4-yl)-1-[2,6-di(propan-2-yl)phenyl]benzimidazole;iridium
CID 156658037
1-[2,6-di(propan-2-yl)phenyl]-2-[7-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;iridium;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane
CID 156657888
6-[1-(4-tert-butyl-2,6-diphenylphenyl)benzimidazol-2-yl]-9-methyl-7H-[1]benzofuro[3,2-b]pyridin-7-ide;octakis(iridium);bis(2-methyl-6-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[3,2-b]pyridin-7-ide);9-methyl-4-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-3H-[1]benzofuro[3,2-b]pyridin-3-ide;tris(9-methyl-6-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[3,2-b]pyridin-7-ide);9-methyl-6-(1-propan-2-ylbenzimidazol-2-yl)-7H-[1]benzofuro[3,2-b]pyridin-7-ide;bis(trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane);tetrakis(trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane);bis(trimethyl-(6-phenyl-3-pyridinyl)silane)
CID 162021649

Frequently Asked Questions

What is the IUPAC name of 1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane?
The IUPAC name of 1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane (CID 160735945) is 1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane.
What is the SMILES notation for 1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane?
The canonical SMILES for 1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane is CC(C)Cc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(C)c1cc(-c2ccccc2)cc(C(C)C)c1-n1c(-c2[c-]ccc3c2oc2ccc(-c4ccccc4-c4ccccc4)cc23)nc2ccccc21.CC(C)c1cc(-c2ccccc2)cc(C(C)C)c1-n1c(-c2[c-]ccc3c2sc2ccc(-c4ccc(-c5ccccc5)cc4)cc23)nc2ccccc21.Cc1cc(C)cc(-c2cccc(-c3ccc4sc5c(-c6nc7ccccc7n6-c6c(C(C)C)cc(C(C)(C)C)cc6C(C)C)[c-]ccc5c4c3)c2)c1.[2H]C(C)(C)c1cc(-c2[c-]cc3ccccc3c2)ncc1[Si](C)(C)C.[2H]C([2H])([2H])c1c[c-]c(-c2cc(C([2H])([2H])C(C)(C)C)c([Si](C)(C)C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc([Si](C)(C)C)cn2)cc1.[2H]C([2H])([2H])c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.[2H]C([2H])([2H])c1nc(C)cc2nc(-c3[c-]ccc4c3oc3ccc(-c5ccc(-c6ccccc6)cc5)cc34)n(-c3c(C(C)C)cccc3C(C)C)c12.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccc2c(oc3ccc(-c4ccc(-c5ccccc5)cc4)cc32)c1-c1nc2ccccc2n1-c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane?
The InChIKey is CSFVZQIMQHQVKE-IOZMIBHLSA-N. The full InChI is InChI=1S/C49H39N2O.C49H39N2S.C49H47N2S.C44H38N3O.C43H27N2O.C21H24NSi.C20H28NSi.C18H24NSi.2C15H18NSi.5Ir/c1-31(2)41-29-36(33-16-7-5-8-17-33)30-42(32(3)4)47(41)51-45-25-14-13-24-44(45)50-49(51)40-23-15-22-39-43-28-35(26-27-46(43)52-48(39)40)38-21-12-11-20-37(38)34-18-9-6-10-19-34;1-31(2)41-29-38(34-16-9-6-10-17-34)30-42(32(3)4)47(41)51-45-21-12-11-20-44(45)50-49(51)40-19-13-18-39-43-28-37(26-27-46(43)52-48(39)40)36-24-22-35(23-25-36)33-14-7-5-8-15-33;1-29(2)40-27-37(49(7,8)9)28-41(30(3)4)46(40)51-44-19-11-10-18-43(44)50-48(51)39-17-13-16-38-42-26-35(20-21-45(42)52-47(38)39)33-14-12-15-34(25-33)36-23-31(5)22-32(6)24-36;1-26(2)34-14-10-15-35(27(3)4)42(34)47-41-29(6)45-28(5)24-39(41)46-44(47)37-17-11-16-36-38-25-33(22-23-40(38)48-43(36)37)32-20-18-31(19-21-32)30-12-8-7-9-13-30;1-3-10-29(11-4-1)31-18-20-33(21-19-31)34-24-27-41-38(28-34)36-14-9-15-37(42(36)46-41)43-44-39-16-7-8-17-40(39)45(43)35-25-22-32(23-26-35)30-12-5-2-6-13-30;1-15(2)19-13-20(22-14-21(19)23(3,4)5)18-11-10-16-8-6-7-9-17(16)12-18;1-15-8-10-16(11-9-15)18-12-17(13-20(2,3)4)19(14-21-18)22(5,6)7;1-14(2)11-16-12-17(15-9-7-6-8-10-15)19-13-18(16)20(3,4)5;1-12-5-7-13(8-6-12)15-10-9-14(11-16-15)17(2,3)4;1-12-10-14(13-8-6-5-7-9-13)16-11-15(12)17(2,3)4;;;;;/h5-22,24-32H,1-4H3;5-18,20-32H,1-4H3;10-16,18-30H,1-9H3;7-16,18-27H,1-6H3;1-14,16-28H;6-10,12-15H,1-5H3;8-10,12,14H,13H2,1-7H3;6-9,12-14H,11H2,1-5H3;5-7,9-11H,1-4H3;5-8,10-11H,1-4H3;;;;;/q10*-1;;;;;/i;;;6D3;;15D;1D3,13D2;;2*1D3;;;;;.
What are the key properties of 1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane?
1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane has a molecular weight of 5636.82 g/mol, XLogP of 86.93, 49 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[8-[3-(3,5-dimethylphenyl)phenyl]-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(2-deuteriopropan-2-yl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;3-[2,6-di(propan-2-yl)phenyl]-6-methyl-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]-4-(trideuteriomethyl)imidazo[4,5-c]pyridine;pentakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(2-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[8-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;1-(4-phenylphenyl)-2-[8-(4-phenylphenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-phenyl-4-(trideuteriomethyl)-3-pyridinyl]silane;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]silane is sourced from PubChem (CID 160735945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).