4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine)

C414H350Ir8N26O2S4 — CID 158382844

IUPAC4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine)
SMILES[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2c(c1)-c1ccccc1C2(C)C.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2c(c1)C(C)(C)c1ccccc1-2.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2c(c1)oc1nc(C)ccc12.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2c(c1)sc1ccccc12.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2c(c1)sc1nc(C)ccc12.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2sc3ccccc3c2c1.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1cccc2c1oc1ccccc12.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1cccc2c1sc1ccccc12.[Ir+3].[Ir+3].[Ir+3].[Ir+3].[Ir+3].[Ir+3].[Ir+3].[Ir+3]
InChIInChI=1S/2C27H22N.C24H17N2O.C24H17N2S.C24H16NO.3C24H16NS.8C14H14N.8C13H12N.8Ir/c1-18-17-28-26(19-9-5-4-6-10-19)16-22(18)20-13-14-25-23(15-20)21-11-7-8-12-24(21)27(25,2)3;1-18-17-28-26(19-9-5-4-6-10-19)16-23(18)20-13-14-22-21-11-7-8-12-24(21)27(2,3)25(22)15-20;2*1-15-14-25-22(17-6-4-3-5-7-17)13-21(15)18-9-11-19-20-10-8-16(2)26-24(20)27-23(19)12-18;2*1-16-15-25-22(17-8-3-2-4-9-17)14-21(16)20-12-7-11-19-18-10-5-6-13-23(18)26-24(19)20;1-16-15-25-22(17-7-3-2-4-8-17)14-20(16)18-11-12-24-21(13-18)19-9-5-6-10-23(19)26-24;1-16-15-25-22(17-7-3-2-4-8-17)14-21(16)18-11-12-20-19-9-5-6-10-23(19)26-24(20)13-18;8*1-10-4-7-14(15-9-10)13-6-5-11(2)12(3)8-13;8*1-10-3-6-12(7-4-10)13-8-5-11(2)9-14-13;;;;;;;;/h2*4-9,11-17H,1-3H3;2*3-6,8-14H,1-2H3;2*2-8,10-15H,1H3;2*2-7,9-15H,1H3;8*4-5,7-9H,1-3H3;8*3-6,8-9H,1-2H3;;;;;;;;/q24*-1;8*+3/i24*1D3;;;;;;;;
InChIKeyXCFLEWJAGCQIRX-BHYXXOOWSA-N
MW7459.98 g/mol
LogP106.58
Rot. Bonds56

About 4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine)

4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine) (PubChem CID 158382844) has the molecular formula C414H350Ir8N26O2S4 and a molecular weight of 7459.98 g/mol. Its IUPAC name is 4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine).

Molecular Properties

Compound Name4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine)
PubChem CID158382844
Molecular FormulaC414H350Ir8N26O2S4
Molecular Weight7459.98 g/mol
Exact Mass7460.85
IUPAC Name4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine)
SMILES[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2c(c1)-c1ccccc1C2(C)C.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2c(c1)C(C)(C)c1ccccc1-2.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2c(c1)oc1nc(C)ccc12.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2c(c1)sc1ccccc12.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2c(c1)sc1nc(C)ccc12.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2sc3ccccc3c2c1.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1cccc2c1oc1ccccc12.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1cccc2c1sc1ccccc12.[Ir+3].[Ir+3].[Ir+3].[Ir+3].[Ir+3].[Ir+3].[Ir+3].[Ir+3]
InChIInChI=1S/2C27H22N.C24H17N2O.C24H17N2S.C24H16NO.3C24H16NS.8C14H14N.8C13H12N.8Ir/c1-18-17-28-26(19-9-5-4-6-10-19)16-22(18)20-13-14-25-23(15-20)21-11-7-8-12-24(21)27(25,2)3;1-18-17-28-26(19-9-5-4-6-10-19)16-23(18)20-13-14-22-21-11-7-8-12-24(21)27(2,3)25(22)15-20;2*1-15-14-25-22(17-6-4-3-5-7-17)13-21(15)18-9-11-19-20-10-8-16(2)26-24(20)27-23(19)12-18;2*1-16-15-25-22(17-8-3-2-4-9-17)14-21(16)20-12-7-11-19-18-10-5-6-13-23(18)26-24(19)20;1-16-15-25-22(17-7-3-2-4-8-17)14-20(16)18-11-12-24-21(13-18)19-9-5-6-10-23(19)26-24;1-16-15-25-22(17-7-3-2-4-8-17)14-21(16)18-11-12-20-19-9-5-6-10-23(19)26-24(20)13-18;8*1-10-4-7-14(15-9-10)13-6-5-11(2)12(3)8-13;8*1-10-3-6-12(7-4-10)13-8-5-11(2)9-14-13;;;;;;;;/h2*4-9,11-17H,1-3H3;2*3-6,8-14H,1-2H3;2*2-8,10-15H,1H3;2*2-7,9-15H,1H3;8*4-5,7-9H,1-3H3;8*3-6,8-9H,1-2H3;;;;;;;;/q24*-1;8*+3/i24*1D3;;;;;;;;
InChIKeyXCFLEWJAGCQIRX-BHYXXOOWSA-N
XLogP106.58
TPSA361.42 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds56
Heavy Atoms454
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5007459.98
LogP ≤ 5106.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

Analyze 4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine) with MolForge

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Launch Full Analysis

Related Compounds

5-(1,1-dideuterio-2,2-dimethylpropyl)-2-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine;tetrakis(3,7-diethyl-6-hydroxynon-5-en-4-one);pentakis(iridium);3-(7-methyl-3H-dibenzofuran-3-id-4-yl)-[1]benzofuro[2,3-c]pyridine;1-(1-methyl-2H-dibenzofuran-2-id-3-yl)-7-(2-methylpropyl)-[1]benzothiolo[2,3-c]pyridine;7-(2-methylpropyl)-1-(2,7,9-trimethyl-3H-dibenzofuran-3-id-4-yl)-[1]benzothiolo[2,3-c]pyridine;7-(2-methylpropyl)-1-(4,9,9-trimethyl-3H-fluoren-3-id-2-yl)-[1]benzothiolo[2,3-c]pyridine;7-(3,3,3-trifluoro-2,2-dimethylpropyl)-1-(2,7,9-trimethyl-3H-dibenzofuran-3-id-4-yl)-[1]benzothiolo[2,3-c]pyridine
CID 163901679
2-([1]Benzothiolo[2,3-b]pyridin-8-yl)-8-[3-(9,9-dimethylfluoren-2-yl)phenyl]-[1]benzofuro[2,3-b]pyridine
CID 122677215
15,15-Diphenyl-18-[4-(2-pyridin-3-yl-4-pyridinyl)phenyl]-4-oxa-26-thia-6-azaheptacyclo[14.11.0.02,14.03,11.05,10.019,27.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,19(27),20,22,24-dodecaene
CID 140939324
2-(3-Dibenzothiophen-1-yl-9,9'-spirobi[xanthene]-3'-yl)pyridine;5-(3-phenyl-9,9'-spirobi[xanthene]-3'-yl)-[1]benzofuro[2,3-b]pyridine;5-(3-phenyl-9,9'-spirobi[xanthene]-3'-yl)-[1]benzothiolo[2,3-b]pyridine;5-(3'-pyridin-2-yl-9,9'-spirobi[xanthene]-3-yl)-[1]benzofuro[2,3-b]pyridine;5-(3'-pyridin-2-yl-9,9'-spirobi[xanthene]-3-yl)-[1]benzothiolo[2,3-b]pyridine
CID 157050417
2-(10-Phenylanthracen-9-yl)spiro[fluorene-9,11'-fluoreno[3,2-b][1]benzofuran];2-(10-phenylanthracen-9-yl)spiro[fluorene-9,11'-fluoreno[3,2-b][1]benzothiole];7'-(10-pyridin-3-ylanthracen-9-yl)spiro[fluoreno[3,2-b][1]benzofuran-11,5'-indeno[1,2-b]pyridine];3-(10-spiro[fluorene-9,11'-fluoreno[3,2-b][1]benzofuran]-2-ylanthracen-9-yl)pyridine;3-(10-spiro[fluorene-9,11'-fluoreno[3,2-b][1]benzothiole]-2-ylanthracen-9-yl)pyridine
CID 157052071
6-(2-Tert-butyl-4-methyl-5-phenyl-1,3-thiazol-3-ium-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine;6-(2-tert-butyl-4-methyl-5-propan-2-yl-1,3-thiazol-3-ium-3-yl)-7-methyl-[1]benzofuro[2,3-b]pyridine;6-[2-(2,6-dimethylphenyl)-4-methyl-5-phenyl-1,3-thiazol-3-ium-3-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine;6-[2-(2,6-dimethylphenyl)-4-methyl-5-propan-2-yl-1,3-thiazol-3-ium-3-yl]-7-methyl-[1]benzofuro[2,3-b]pyridine;7-methyl-6-(4-methyl-2,5-diphenyl-1,3-thiazol-3-ium-3-yl)-[1]benzofuro[2,3-b]pyridine;7-methyl-6-(4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazol-3-ium-3-yl)-[1]benzofuro[2,3-b]pyridine
CID 157054593
2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;pentakis(iridium);4-methyl-2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;5-methyl-2-phenylpyridine;tris(2-phenylpyridine)
CID 157066201
CID 157068803
CID 157068803
14-Methyl-13-(3-methyl-1-benzofuran-2-yl)-17-thia-14-azoniatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11,13,15-octaene;14-methyl-13-(3-methyl-1-benzothiophen-2-yl)-17-thia-14-azoniatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11,13,15-octaene;14-methyl-13-(3-methyl-1-benzothiophen-2-yl)-17-thia-14-azoniatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11,13,15-octaene;15-methyl-14-(2-methylphenyl)-17-thia-15-azoniatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene
CID 157071825
2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-5-methylpyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-phenylpyridine;bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;2-(3H-dibenzothiophen-3-id-2-yl)pyridine;4-hydroxypent-3-en-2-one;octakis(iridium);4-methyl-2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;tris(5-methyl-2-phenylpyridine);bis(2-phenylpyridine)
CID 157097202
3-(9-Dibenzofuran-2-ylcarbazol-2-yl)-9-(4-phenylphenyl)carbazole;3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(3-phenyl-5-pyridin-2-ylphenyl)carbazole;3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(3-phenyl-5-pyridin-2-ylphenyl)carbazole;3-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]-9-(3,5-diphenylphenyl)carbazole;3-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]-9-(3-phenyl-5-pyridin-2-ylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-phenyl-5-pyridin-2-ylphenyl)carbazole
CID 157097686
5-benzyl-7,7-dimethyl-10-pyridin-2-yl-9H-indeno[2,1-b]carbazol-9-ide;10,10-diethyl-6-phenyl-14-oxa-7-azapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10,10-dimethyl-6-phenyl-14-thia-7-azapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10,10-dimethyl-6-(4-propan-2-ylbenzene-6-id-1-yl)-14-oxa-7-azapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;tetrakis(iridium);5-methyl-2-phenylpyridine;tris(2-phenylpyridine)
CID 157099471

Frequently Asked Questions

What is the IUPAC name of 4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine)?
The IUPAC name of 4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine) (CID 158382844) is 4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine).
What is the SMILES notation for 4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine)?
The canonical SMILES for 4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine) is [2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2ccc(C)cn2)cc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c(C)c2)nc1.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2c(c1)-c1ccccc1C2(C)C.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2c(c1)C(C)(C)c1ccccc1-2.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2c(c1)oc1nc(C)ccc12.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2c(c1)sc1ccccc12.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2c(c1)sc1nc(C)ccc12.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1ccc2sc3ccccc3c2c1.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1cccc2c1oc1ccccc12.[2H]C([2H])([2H])c1cnc(-c2[c-]cccc2)cc1-c1cccc2c1sc1ccccc12.[Ir+3].[Ir+3].[Ir+3].[Ir+3].[Ir+3].[Ir+3].[Ir+3].[Ir+3].
What is the InChIKey of 4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine)?
The InChIKey is XCFLEWJAGCQIRX-BHYXXOOWSA-N. The full InChI is InChI=1S/2C27H22N.C24H17N2O.C24H17N2S.C24H16NO.3C24H16NS.8C14H14N.8C13H12N.8Ir/c1-18-17-28-26(19-9-5-4-6-10-19)16-22(18)20-13-14-25-23(15-20)21-11-7-8-12-24(21)27(25,2)3;1-18-17-28-26(19-9-5-4-6-10-19)16-23(18)20-13-14-22-21-11-7-8-12-24(21)27(2,3)25(22)15-20;2*1-15-14-25-22(17-6-4-3-5-7-17)13-21(15)18-9-11-19-20-10-8-16(2)26-24(20)27-23(19)12-18;2*1-16-15-25-22(17-8-3-2-4-9-17)14-21(16)20-12-7-11-19-18-10-5-6-13-23(18)26-24(19)20;1-16-15-25-22(17-7-3-2-4-8-17)14-20(16)18-11-12-24-21(13-18)19-9-5-6-10-23(19)26-24;1-16-15-25-22(17-7-3-2-4-8-17)14-21(16)18-11-12-20-19-9-5-6-10-23(19)26-24(20)13-18;8*1-10-4-7-14(15-9-10)13-6-5-11(2)12(3)8-13;8*1-10-3-6-12(7-4-10)13-8-5-11(2)9-14-13;;;;;;;;/h2*4-9,11-17H,1-3H3;2*3-6,8-14H,1-2H3;2*2-8,10-15H,1H3;2*2-7,9-15H,1H3;8*4-5,7-9H,1-3H3;8*3-6,8-9H,1-2H3;;;;;;;;/q24*-1;8*+3/i24*1D3;;;;;;;;.
What are the key properties of 4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine)?
4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine) has a molecular weight of 7459.98 g/mol, XLogP of 106.58, 56 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dibenzofuran-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-3-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-dibenzothiophen-4-yl-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(2-(3,4-dimethylbenzene-6-id-1-yl)-5-(trideuteriomethyl)pyridine);4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;octakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzofuro[2,3-b]pyridine;2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;octakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine) is sourced from PubChem (CID 158382844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).