[6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole

C303H316FGe5Ir5N15S5-10 — CID 159363309

IUPAC[6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole
SMILESCC(C)c1cc(-c2ccccc2)cc(C(C)C)c1-n1c(-c2[c-]cc(F)c3c2sc2ccccc23)nc2ccccc21.CC(C)c1cc(-c2ccccc2)cc(C(C)C)c1-n1c(-c2[c-]ccc3c2sc2cc4c(cc23)CCCC4)nc2ccccc21.C[Ge](C)(C)c1cnc(-c2[c-]cccc2)cc1CC1CCCC1.C[Ge](C)(C)c1cnc(-c2[c-]cccc2)cc1CC1CCCCC1.Cc1c[c-]c(-c2nc3ccccc3n2-c2c(C(C)C)cc(-c3ccccc3)cc2C(C)C)c2sc3cc4ccccc4cc3c12.Cc1ccc2c(c1)sc1c(-c3nc4ccccc4n3-c3c(C(C)C)cc(-c4ccccc4)cc3C(C)C)[c-]cc(C)c12.Cc1ccc2c(c1)sc1c(-c3nc4ccccc4n3-c3c(C(C)C)cc(-c4ccccc4)cc3C(C)C)[c-]cc(C)c12.[2H]C([2H])([2H])c1c[c-]c(-c2cc(C([2H])([2H])C(C)(C)C)c([Ge](C)(C)C)cn2)cc1.[2H]C([2H])(c1cc(-c2[c-]ccc(C(C)(C)C)c2)ncc1[Ge](C)(C)C)C(C)(C)C.[2H]C([2H])(c1cc(-c2[c-]ccc(C)c2)ncc1[Ge](C)(C)C)C1CCCC1.[Ir].[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C42H35N2S.C41H37N2S.2C39H35N2S.C37H30FN2S.C23H34GeN.2C21H28GeN.C20H26GeN.C20H28GeN.5Ir/c1-25(2)33-22-31(28-13-7-6-8-14-28)23-34(26(3)4)40(33)44-37-18-12-11-17-36(37)43-42(44)32-20-19-27(5)39-35-21-29-15-9-10-16-30(29)24-38(35)45-41(32)39;1-25(2)33-22-30(27-13-6-5-7-14-27)23-34(26(3)4)39(33)43-37-20-11-10-19-36(37)42-41(43)32-18-12-17-31-35-21-28-15-8-9-16-29(28)24-38(35)44-40(31)32;2*1-23(2)31-21-28(27-12-8-7-9-13-27)22-32(24(3)4)37(31)41-34-15-11-10-14-33(34)40-39(41)30-19-17-26(6)36-29-18-16-25(5)20-35(29)42-38(30)36;1-22(2)28-20-25(24-12-6-5-7-13-24)21-29(23(3)4)35(28)40-32-16-10-9-15-31(32)39-37(40)27-18-19-30(38)34-26-14-8-11-17-33(26)41-36(27)34;1-22(2,3)15-18-14-21(25-16-20(18)24(7,8)9)17-11-10-12-19(13-17)23(4,5)6;1-16-8-7-11-18(12-16)21-14-19(13-17-9-5-6-10-17)20(15-23-21)22(2,3)4;1-22(2,3)20-16-23-21(18-12-8-5-9-13-18)15-19(20)14-17-10-6-4-7-11-17;1-21(2,3)19-15-22-20(17-11-5-4-6-12-17)14-18(19)13-16-9-7-8-10-16;1-15-8-10-16(11-9-15)19-12-17(13-20(2,3)4)18(14-22-19)21(5,6)7;;;;;/h6-19,21-26H,1-5H3;5-7,10-14,17,19-26H,8-9,15-16H2,1-4H3;2*7-18,20-24H,1-6H3;5-17,19-23H,1-4H3;10,12-14,16H,15H2,1-9H3;7-8,12,14-15,17H,5-6,9-10,13H2,1-4H3;5,8-9,12,15-17H,4,6-7,10-11,14H2,1-3H3;4-6,11,14-16H,7-10,13H2,1-3H3;8-10,12,14H,13H2,1-7H3;;;;;/q10*-1;;;;;/i;;;;;15D2;13D2;;;1D3,13D2;;;;;
InChIKeyAHBHMIZWJXDROB-JCOZEJAISA-N
MW5680.49 g/mol
LogP83.72
Rot. Bonds44

About [6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole

[6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole (PubChem CID 159363309) has the molecular formula C303H316FGe5Ir5N15S5-10 and a molecular weight of 5680.49 g/mol. Its IUPAC name is [6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole.

Molecular Properties

Compound Name[6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole
PubChem CID159363309
Molecular FormulaC303H316FGe5Ir5N15S5-10
Molecular Weight5680.49 g/mol
Exact Mass5686.86
IUPAC Name[6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole
SMILESCC(C)c1cc(-c2ccccc2)cc(C(C)C)c1-n1c(-c2[c-]cc(F)c3c2sc2ccccc23)nc2ccccc21.CC(C)c1cc(-c2ccccc2)cc(C(C)C)c1-n1c(-c2[c-]ccc3c2sc2cc4c(cc23)CCCC4)nc2ccccc21.C[Ge](C)(C)c1cnc(-c2[c-]cccc2)cc1CC1CCCC1.C[Ge](C)(C)c1cnc(-c2[c-]cccc2)cc1CC1CCCCC1.Cc1c[c-]c(-c2nc3ccccc3n2-c2c(C(C)C)cc(-c3ccccc3)cc2C(C)C)c2sc3cc4ccccc4cc3c12.Cc1ccc2c(c1)sc1c(-c3nc4ccccc4n3-c3c(C(C)C)cc(-c4ccccc4)cc3C(C)C)[c-]cc(C)c12.Cc1ccc2c(c1)sc1c(-c3nc4ccccc4n3-c3c(C(C)C)cc(-c4ccccc4)cc3C(C)C)[c-]cc(C)c12.[2H]C([2H])([2H])c1c[c-]c(-c2cc(C([2H])([2H])C(C)(C)C)c([Ge](C)(C)C)cn2)cc1.[2H]C([2H])(c1cc(-c2[c-]ccc(C(C)(C)C)c2)ncc1[Ge](C)(C)C)C(C)(C)C.[2H]C([2H])(c1cc(-c2[c-]ccc(C)c2)ncc1[Ge](C)(C)C)C1CCCC1.[Ir].[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C42H35N2S.C41H37N2S.2C39H35N2S.C37H30FN2S.C23H34GeN.2C21H28GeN.C20H26GeN.C20H28GeN.5Ir/c1-25(2)33-22-31(28-13-7-6-8-14-28)23-34(26(3)4)40(33)44-37-18-12-11-17-36(37)43-42(44)32-20-19-27(5)39-35-21-29-15-9-10-16-30(29)24-38(35)45-41(32)39;1-25(2)33-22-30(27-13-6-5-7-14-27)23-34(26(3)4)39(33)43-37-20-11-10-19-36(37)42-41(43)32-18-12-17-31-35-21-28-15-8-9-16-29(28)24-38(35)44-40(31)32;2*1-23(2)31-21-28(27-12-8-7-9-13-27)22-32(24(3)4)37(31)41-34-15-11-10-14-33(34)40-39(41)30-19-17-26(6)36-29-18-16-25(5)20-35(29)42-38(30)36;1-22(2)28-20-25(24-12-6-5-7-13-24)21-29(23(3)4)35(28)40-32-16-10-9-15-31(32)39-37(40)27-18-19-30(38)34-26-14-8-11-17-33(26)41-36(27)34;1-22(2,3)15-18-14-21(25-16-20(18)24(7,8)9)17-11-10-12-19(13-17)23(4,5)6;1-16-8-7-11-18(12-16)21-14-19(13-17-9-5-6-10-17)20(15-23-21)22(2,3)4;1-22(2,3)20-16-23-21(18-12-8-5-9-13-18)15-19(20)14-17-10-6-4-7-11-17;1-21(2,3)19-15-22-20(17-11-5-4-6-12-17)14-18(19)13-16-9-7-8-10-16;1-15-8-10-16(11-9-15)19-12-17(13-20(2,3)4)18(14-22-19)21(5,6)7;;;;;/h6-19,21-26H,1-5H3;5-7,10-14,17,19-26H,8-9,15-16H2,1-4H3;2*7-18,20-24H,1-6H3;5-17,19-23H,1-4H3;10,12-14,16H,15H2,1-9H3;7-8,12,14-15,17H,5-6,9-10,13H2,1-4H3;5,8-9,12,15-17H,4,6-7,10-11,14H2,1-3H3;4-6,11,14-16H,7-10,13H2,1-3H3;8-10,12,14H,13H2,1-7H3;;;;;/q10*-1;;;;;/i;;;;;15D2;13D2;;;1D3,13D2;;;;;
InChIKeyAHBHMIZWJXDROB-JCOZEJAISA-N
XLogP83.72
TPSA153.55 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds44
Heavy Atoms334
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005680.49
LogP ≤ 583.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze [6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole with MolForge

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Related Compounds

[6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;1-(4-tert-butyl-2-phenylphenyl)-2-(7-cyclohexyl-3H-dibenzothiophen-3-id-4-yl)benzimidazole;1-(4-tert-butyl-2-phenylphenyl)-2-(7-cyclopentyl-3H-dibenzothiophen-3-id-4-yl)benzimidazole;1-(2-tert-butyl-4-phenylphenyl)-2-(7-methyl-3H-dibenzothiophen-3-id-4-yl)benzimidazole;bis(1-(4-tert-butyl-2-phenylphenyl)-2-(7-methyl-3H-dibenzothiophen-3-id-4-yl)benzimidazole);[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;pentakis(iridium)
CID 161036946
[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-[4-tert-butyl-2,6-di(propan-2-yl)phenyl]-2-[7-(4-phenylphenyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;iridium
CID 167355538
[6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;2-(3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;iridium
CID 156660175
[4-[cyclohexyl(dideuterio)methyl]-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;2-(7-dibenzofuran-3-yl-3H-dibenzofuran-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);tetrakis(2-(7-phenyl-3H-dibenzofuran-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);trimethyl-[6-(2H-naphthalen-2-id-1-yl)-3-pyridinyl]germane
CID 158779655
[6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylsilane;[4-[cyclohexyl(dideuterio)methyl]-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylsilane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;2-(7-dibenzofuran-3-yl-3H-dibenzothiophen-3-id-4-yl)-1-(2-phenylphenyl)benzimidazole;1-(2,6-diphenylphenyl)-2-(7-pyridin-4-yl-3H-dibenzothiophen-3-id-4-yl)benzimidazole;pentakis(iridium);2-(7-naphthalen-2-yl-3H-dibenzothiophen-3-id-4-yl)-1-(2-phenylphenyl)benzimidazole;bis(2-(7-phenyl-3H-dibenzothiophen-3-id-4-yl)-1-(2-phenylphenyl)benzimidazole)
CID 163471366
1-(4-tert-butyl-2-phenylphenyl)-2-(7-methyl-3H-dibenzothiophen-3-id-4-yl)benzimidazole;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;iridium
CID 156659174
8-[1-[2,6-bis(2-deuteriopropan-2-yl)-4-phenylphenyl]benzimidazol-2-yl]-3,5-dimethyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2-methylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2-methylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;5-fluoro-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-5-(trideuteriomethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2,3,5-trimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide
CID 158052637
[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylsilane;2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-3-[4-phenyl-2,6-di(propan-2-yl)phenyl]imidazo[4,5-c]pyridine;iridium
CID 156658031
[6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylsilane;2-(8-cyclohexyl-3H-dibenzothiophen-3-id-2-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;bis([4-(1,1-dideuterio-2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane);2-(7,8-dimethyl-3H-dibenzothiophen-3-id-2-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;[4-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylsilane;2-(7-fluoro-3H-dibenzothiophen-3-id-2-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;tetrakis(iridium);1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[7-(trideuteriomethyl)-3H-dibenzothiophen-3-id-2-yl]benzimidazole
CID 163633591
2-(8-cyclohexyl-3H-dibenzothiophen-3-id-2-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-(2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;tris(iridium);2-(4-methyl-3H-dibenzothiophen-3-id-2-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[7-(trideuteriomethyl)-3H-dibenzothiophen-3-id-2-yl]benzimidazole;trimethyl-[4-(2-methylpropyl)-6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]germane
CID 158352436
iridium;1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[1-(trideuteriomethyl)-3H-dibenzothiophen-3-id-4-yl]benzimidazole;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]germane
CID 156660240

Frequently Asked Questions

What is the IUPAC name of [6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole?
The IUPAC name of [6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole (CID 159363309) is [6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole.
What is the SMILES notation for [6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole?
The canonical SMILES for [6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole is CC(C)c1cc(-c2ccccc2)cc(C(C)C)c1-n1c(-c2[c-]cc(F)c3c2sc2ccccc23)nc2ccccc21.CC(C)c1cc(-c2ccccc2)cc(C(C)C)c1-n1c(-c2[c-]ccc3c2sc2cc4c(cc23)CCCC4)nc2ccccc21.C[Ge](C)(C)c1cnc(-c2[c-]cccc2)cc1CC1CCCC1.C[Ge](C)(C)c1cnc(-c2[c-]cccc2)cc1CC1CCCCC1.Cc1c[c-]c(-c2nc3ccccc3n2-c2c(C(C)C)cc(-c3ccccc3)cc2C(C)C)c2sc3cc4ccccc4cc3c12.Cc1ccc2c(c1)sc1c(-c3nc4ccccc4n3-c3c(C(C)C)cc(-c4ccccc4)cc3C(C)C)[c-]cc(C)c12.Cc1ccc2c(c1)sc1c(-c3nc4ccccc4n3-c3c(C(C)C)cc(-c4ccccc4)cc3C(C)C)[c-]cc(C)c12.[2H]C([2H])([2H])c1c[c-]c(-c2cc(C([2H])([2H])C(C)(C)C)c([Ge](C)(C)C)cn2)cc1.[2H]C([2H])(c1cc(-c2[c-]ccc(C(C)(C)C)c2)ncc1[Ge](C)(C)C)C(C)(C)C.[2H]C([2H])(c1cc(-c2[c-]ccc(C)c2)ncc1[Ge](C)(C)C)C1CCCC1.[Ir].[Ir].[Ir].[Ir].[Ir].
What is the InChIKey of [6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole?
The InChIKey is AHBHMIZWJXDROB-JCOZEJAISA-N. The full InChI is InChI=1S/C42H35N2S.C41H37N2S.2C39H35N2S.C37H30FN2S.C23H34GeN.2C21H28GeN.C20H26GeN.C20H28GeN.5Ir/c1-25(2)33-22-31(28-13-7-6-8-14-28)23-34(26(3)4)40(33)44-37-18-12-11-17-36(37)43-42(44)32-20-19-27(5)39-35-21-29-15-9-10-16-30(29)24-38(35)45-41(32)39;1-25(2)33-22-30(27-13-6-5-7-14-27)23-34(26(3)4)39(33)43-37-20-11-10-19-36(37)42-41(43)32-18-12-17-31-35-21-28-15-8-9-16-29(28)24-38(35)44-40(31)32;2*1-23(2)31-21-28(27-12-8-7-9-13-27)22-32(24(3)4)37(31)41-34-15-11-10-14-33(34)40-39(41)30-19-17-26(6)36-29-18-16-25(5)20-35(29)42-38(30)36;1-22(2)28-20-25(24-12-6-5-7-13-24)21-29(23(3)4)35(28)40-32-16-10-9-15-31(32)39-37(40)27-18-19-30(38)34-26-14-8-11-17-33(26)41-36(27)34;1-22(2,3)15-18-14-21(25-16-20(18)24(7,8)9)17-11-10-12-19(13-17)23(4,5)6;1-16-8-7-11-18(12-16)21-14-19(13-17-9-5-6-10-17)20(15-23-21)22(2,3)4;1-22(2,3)20-16-23-21(18-12-8-5-9-13-18)15-19(20)14-17-10-6-4-7-11-17;1-21(2,3)19-15-22-20(17-11-5-4-6-12-17)14-18(19)13-16-9-7-8-10-16;1-15-8-10-16(11-9-15)19-12-17(13-20(2,3)4)18(14-22-19)21(5,6)7;;;;;/h6-19,21-26H,1-5H3;5-7,10-14,17,19-26H,8-9,15-16H2,1-4H3;2*7-18,20-24H,1-6H3;5-17,19-23H,1-4H3;10,12-14,16H,15H2,1-9H3;7-8,12,14-15,17H,5-6,9-10,13H2,1-4H3;5,8-9,12,15-17H,4,6-7,10-11,14H2,1-3H3;4-6,11,14-16H,7-10,13H2,1-3H3;8-10,12,14H,13H2,1-7H3;;;;;/q10*-1;;;;;/i;;;;;15D2;13D2;;;1D3,13D2;;;;;.
What are the key properties of [6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole?
[6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole has a molecular weight of 5680.49 g/mol, XLogP of 83.72, 44 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-tert-butylbenzene-6-id-1-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-[cyclopentyl(dideuterio)methyl]-6-(3-methylbenzene-6-id-1-yl)-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane;bis(2-(1,7-dimethyl-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole);2-(1-fluoro-3H-dibenzothiophen-3-id-4-yl)-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;pentakis(iridium);2-(1-methyl-3H-naphtho[2,3-b][1]benzothiol-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-(7,8,9,10-tetrahydro-3H-naphtho[2,3-b][1]benzothiol-3-id-4-yl)benzimidazole is sourced from PubChem (CID 159363309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).