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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine)

C224H173Ir4N17O4S4 — CID 158521772

IUPAC4-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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(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])c1ccc(-c2[c-]cc(C)c3c2oc2nc(C)ccc23)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c3c2oc2nc(C)ccc23)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c3c2oc2nc(C)ccc23)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c3c2oc2nc(C)ccc23)nc1.[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-c1cccc2c1sc1ccccc12.[Ir+3].[Ir+3].[Ir+3].[Ir+3]
InChIInChI=1S/C24H17N2S.3C24H16NS.4C19H15N2O.4C13H12N.4Ir/c1-15-14-25-22(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;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;4*1-11-4-9-16(20-10-11)14-7-5-12(2)17-15-8-6-13(3)21-19(15)22-18(14)17;4*1-10-3-6-12(7-4-10)13-8-5-11(2)9-14-13;;;;/h3-6,8-14H,1-2H3;2-8,10-15H,1H3;2*2-7,9-15H,1H3;4*4-6,8-10H,1-3H3;4*3-6,8-9H,1-2H3;;;;/q12*-1;4*+3/i12*1D3;;;;
InChIKeyPDPJYLONYOSHIX-DXXYDTFWSA-N
MW4100.32 g/mol
LogP59.00
Rot. Bonds28

About 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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine) (PubChem CID 158521772) has the molecular formula C224H173Ir4N17O4S4 and a molecular weight of 4100.32 g/mol. Its IUPAC name is 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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine).

Molecular Properties

Compound Name4-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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine)
PubChem CID158521772
Molecular FormulaC224H173Ir4N17O4S4
Molecular Weight4100.32 g/mol
Exact Mass4100.35
IUPAC Name4-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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(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])c1ccc(-c2[c-]cc(C)c3c2oc2nc(C)ccc23)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c3c2oc2nc(C)ccc23)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c3c2oc2nc(C)ccc23)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c3c2oc2nc(C)ccc23)nc1.[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-c1cccc2c1sc1ccccc12.[Ir+3].[Ir+3].[Ir+3].[Ir+3]
InChIInChI=1S/C24H17N2S.3C24H16NS.4C19H15N2O.4C13H12N.4Ir/c1-15-14-25-22(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;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;4*1-11-4-9-16(20-10-11)14-7-5-12(2)17-15-8-6-13(3)21-19(15)22-18(14)17;4*1-10-3-6-12(7-4-10)13-8-5-11(2)9-14-13;;;;/h3-6,8-14H,1-2H3;2-8,10-15H,1H3;2*2-7,9-15H,1H3;4*4-6,8-10H,1-3H3;4*3-6,8-9H,1-2H3;;;;/q12*-1;4*+3/i12*1D3;;;;
InChIKeyPDPJYLONYOSHIX-DXXYDTFWSA-N
XLogP59.00
TPSA271.69 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds28
Heavy Atoms253
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004100.32
LogP ≤ 559.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Analyze 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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine) with MolForge

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Launch Full Analysis

Related Compounds

5-[2-[3-[2-[2-[5-[2-[3,5-bis[2-[8-pyridin-2-yl-2-(trideuteriomethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-id-5-yl]phenyl]phenyl]phenyl]-3H-pyridin-3-id-2-yl]-3H-pyridin-3-id-5-yl]phenyl]-5-[2-[8-pyridin-2-yl-2-(trideuteriomethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-id-5-yl]phenyl]phenyl]phenyl]-8-pyridin-2-yl-2-(trideuteriomethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;bis(iridium(3+))
CID 153448931
5-[2-[3-[2-[2-[5-[2-[3,5-bis[2-(2-methyl-8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-id-5-yl)phenyl]phenyl]phenyl]-3H-pyridin-3-id-2-yl]-3H-pyridin-3-id-5-yl]phenyl]-5-[2-(2-methyl-8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-id-5-yl)phenyl]phenyl]phenyl]-2-methyl-8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;bis(iridium(3+))
CID 153448978
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
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-[1,7-bis(trideuteriomethyl)-3H-dibenzofuran-3-id-4-yl]-5,5,8,8-tetradeuterio-6,7-dihydroisoquinoline;2-[1,7-bis(trideuteriomethyl)-3H-dibenzothiophen-3-id-4-yl]-4-(trideuteriomethyl)pyridine;4-[cyclopentyl(dideuterio)methyl]-5-(2-deuteriopropan-2-yl)-2-[1-fluoro-7-(trideuteriomethyl)-3H-dibenzofuran-3-id-4-yl]pyridine;[6-(3H-dibenzothiophen-3-id-2-yl)-4-(1,1-dideuterio-2,2-dimethylpropyl)-3-pyridinyl]-trimethylgermane;[4-(1,1-dideuterio-2,2-dimethylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane;bis([4-(1,1-dideuterio-2-methylpropyl)-6-phenyl-3-pyridinyl]-trimethylgermane);tetrakis(iridium);2-[7-(trideuteriomethyl)-3H-dibenzothiophen-3-id-4-yl]pyridine
CID 157246570
4-(9,9-dimethylfluoren-2-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-5-(trideuteriomethyl)pyridine;pentakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);pentakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;pentakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine);4-naphthalen-1-yl-2-phenyl-5-(trideuteriomethyl)pyridine;4-naphthalen-2-yl-2-phenyl-5-(trideuteriomethyl)pyridine
CID 157261291
2-(3-Dibenzofuran-3-ylbenzene-6-id-1-yl)pyridine;2-(3-dibenzothiophen-3-ylbenzene-6-id-1-yl)pyridine;2-(4-dibenzothiophen-3-ylbenzene-6-id-1-yl)pyridine;2-(4-dibenzothiophen-4-ylbenzene-6-id-1-yl)pyridine;tetrakis(iridium);tetrakis(2-methyl-6-phenylpyridine)
CID 157311340
2-(3H-dibenzothiophen-3-id-4-yl)-4-phenylpyridine;4,5-dimethyl-2-phenylpyridine;3-(9,9-dimethyl-3H-xanthen-3-id-4-yl)-[1]benzothiolo[2,3-c]pyridine;2-(9,9-dimethyl-2H-xanthen-2-id-1-yl)pyridine;2-(9,9-dimethyl-3H-xanthen-3-id-2-yl)pyridine;3-(9,9-diphenyl-3H-xanthen-3-id-4-yl)-9,9-dimethyl-8,8a-dihydroindeno[2,1-c]pyridine;tetrakis(iridium);2-(8-phenyl-3H-dibenzothiophen-3-id-4-yl)pyridine;2-phenylpyridine
CID 157381603
2-(3H-dibenzofuran-3-id-4-yl)-4-(4-methylphenyl)pyridine;2-(3H-dibenzofuran-3-id-4-yl)-4-methylpyridine;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;dodecakis(iridium);4-methyl-2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;bis(4-methyl-5-phenyl-2-phenylpyridine);4-methyl-2-phenylpyridine;tetrakis(5-methyl-2-phenylpyridine);4-phenyl-2-phenylpyridine;tetrakis(2-phenylpyridine)
CID 157561310
4,5-dimethyl-2-phenylpyridine;3-(9,9-dimethyl-3H-xanthen-3-id-4-yl)-[1]benzothiolo[2,3-c]pyridine;2-(9,9-dimethyl-3H-xanthen-3-id-2-yl)pyridine;3-(9,9-diphenyl-3H-xanthen-3-id-4-yl)-9,9-dimethyl-8,8a-dihydroindeno[2,1-c]pyridine;tris(iridium);2-(8-phenyl-3H-dibenzothiophen-3-id-4-yl)pyridine;2-phenylpyridine
CID 157573381
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
2-(3-Dibenzofuran-4-ylbenzene-6-id-1-yl)pyridine;2-(3-dibenzothiophen-4-ylbenzene-6-id-1-yl)-4-methylpyridine;tris(2-(3-dibenzothiophen-4-ylbenzene-6-id-1-yl)pyridine);pentakis(iridium);bis(2-methyl-6-phenylpyridine);3-methyl-2-phenylpyridine;bis(2-phenylpyridine)
CID 159130652

Frequently Asked Questions

What is the IUPAC name of 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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine)?
The IUPAC name of 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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine) (CID 158521772) is 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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine).
What is the SMILES notation for 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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine)?
The canonical SMILES for 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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(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])c1ccc(-c2[c-]cc(C)c3c2oc2nc(C)ccc23)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c3c2oc2nc(C)ccc23)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c3c2oc2nc(C)ccc23)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cc(C)c3c2oc2nc(C)ccc23)nc1.[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-c1cccc2c1sc1ccccc12.[Ir+3].[Ir+3].[Ir+3].[Ir+3].
What is the InChIKey of 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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine)?
The InChIKey is PDPJYLONYOSHIX-DXXYDTFWSA-N. The full InChI is InChI=1S/C24H17N2S.3C24H16NS.4C19H15N2O.4C13H12N.4Ir/c1-15-14-25-22(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;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;4*1-11-4-9-16(20-10-11)14-7-5-12(2)17-15-8-6-13(3)21-19(15)22-18(14)17;4*1-10-3-6-12(7-4-10)13-8-5-11(2)9-14-13;;;;/h3-6,8-14H,1-2H3;2-8,10-15H,1H3;2*2-7,9-15H,1H3;4*4-6,8-10H,1-3H3;4*3-6,8-9H,1-2H3;;;;/q12*-1;4*+3/i12*1D3;;;;.
What are the key properties of 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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine) has a molecular weight of 4100.32 g/mol, XLogP of 59.00, 28 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 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;tetrakis(2,5-dimethyl-8-[5-(trideuteriomethyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide);tetrakis(iridium(3+));2-methyl-7-[2-phenyl-5-(trideuteriomethyl)-4-pyridinyl]-[1]benzothiolo[2,3-b]pyridine;tetrakis(5-methyl-2-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridine) is sourced from PubChem (CID 158521772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).