[3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane

C170H125N7O2SSi3 — CID 159149938

IUPAC[3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane
SMILESCc1cccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-c3cc(-c4cccc5c4Oc4ccccc4C5(C)C)nc4c3ccc3c(-c5ccccc5)ccnc34)c2)c1.Cc1cccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-c3cc(-c4cccc5c4Oc4ccccc4C5(C)C)nc4c3ccc3cccnc34)c2)c1.Cc1cccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-c3cc(-c4cccc5c4sc4ccccc45)nc4c3ccc3c(-c5ccccc5)cc(-c5ccccn5)nc34)c2)c1
InChIInChI=1S/C60H41N3SSi.C58H44N2OSi.C52H40N2OSi/c1-40-18-15-26-45(36-40)65(43-22-7-3-8-23-43,44-24-9-4-10-25-44)46-27-16-21-42(37-46)53-38-55(51-30-17-29-50-47-28-11-12-32-57(47)64-60(50)51)62-58-49(53)34-33-48-52(41-19-5-2-6-20-41)39-56(63-59(48)58)54-31-13-14-35-61-54;1-39-18-15-26-44(36-39)62(42-22-9-5-10-23-42,43-24-11-6-12-25-43)45-27-16-21-41(37-45)50-38-53(49-28-17-30-52-57(49)61-54-31-14-13-29-51(54)58(52,2)3)60-56-48(50)33-32-47-46(34-35-59-55(47)56)40-19-7-4-8-20-40;1-35-16-12-23-40(32-35)56(38-19-6-4-7-20-38,39-21-8-5-9-22-39)41-24-13-17-37(33-41)44-34-47(54-50-42(44)30-29-36-18-15-31-53-49(36)50)43-25-14-27-46-51(43)55-48-28-11-10-26-45(48)52(46,2)3/h2-39H,1H3;4-38H,1-3H3;4-34H,1-3H3
InChIKeyKJDNBJYNQFGIOT-UHFFFAOYSA-N
MW2414.24 g/mol
LogP35.04
Rot. Bonds21

About [3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane

[3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane (PubChem CID 159149938) has the molecular formula C170H125N7O2SSi3 and a molecular weight of 2414.24 g/mol. Its IUPAC name is [3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane.

Molecular Properties

Compound Name[3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane
PubChem CID159149938
Molecular FormulaC170H125N7O2SSi3
Molecular Weight2414.24 g/mol
Exact Mass2411.89
IUPAC Name[3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane
SMILESCc1cccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-c3cc(-c4cccc5c4Oc4ccccc4C5(C)C)nc4c3ccc3c(-c5ccccc5)ccnc34)c2)c1.Cc1cccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-c3cc(-c4cccc5c4Oc4ccccc4C5(C)C)nc4c3ccc3cccnc34)c2)c1.Cc1cccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-c3cc(-c4cccc5c4sc4ccccc45)nc4c3ccc3c(-c5ccccc5)cc(-c5ccccn5)nc34)c2)c1
InChIInChI=1S/C60H41N3SSi.C58H44N2OSi.C52H40N2OSi/c1-40-18-15-26-45(36-40)65(43-22-7-3-8-23-43,44-24-9-4-10-25-44)46-27-16-21-42(37-46)53-38-55(51-30-17-29-50-47-28-11-12-32-57(47)64-60(50)51)62-58-49(53)34-33-48-52(41-19-5-2-6-20-41)39-56(63-59(48)58)54-31-13-14-35-61-54;1-39-18-15-26-44(36-39)62(42-22-9-5-10-23-42,43-24-11-6-12-25-43)45-27-16-21-41(37-45)50-38-53(49-28-17-30-52-57(49)61-54-31-14-13-29-51(54)58(52,2)3)60-56-48(50)33-32-47-46(34-35-59-55(47)56)40-19-7-4-8-20-40;1-35-16-12-23-40(32-35)56(38-19-6-4-7-20-38,39-21-8-5-9-22-39)41-24-13-17-37(33-41)44-34-47(54-50-42(44)30-29-36-18-15-31-53-49(36)50)43-25-14-27-46-51(43)55-48-28-11-10-26-45(48)52(46,2)3/h2-39H,1H3;4-38H,1-3H3;4-34H,1-3H3
InChIKeyKJDNBJYNQFGIOT-UHFFFAOYSA-N
XLogP35.04
TPSA108.69 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds21
Heavy Atoms183
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002414.24
LogP ≤ 535.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze [3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane with MolForge

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Related Compounds

2-[2-(1,10-Phenanthrolin-2-yl)spiro[thioxanthene-9,9'-xanthene]-2'-yl]-1,10-phenanthroline
CID 59096361
2-[3-ethenyl-2'-(1,10-phenanthrolin-2-yl)-2-[(Z)-prop-1-enyl]spiro[thiochromene-4,9'-xanthene]-6-yl]-1,10-phenanthroline
CID 68247462
8-Methoxy-1-[4-(9-phenyl-1,10-phenanthrolin-2-yl)phenyl]-[1]benzothiolo[3,2-c]pyridine
CID 90050097
2-(9b-methyl-4aH-dibenzofuran-4-yl)-9-[3-[3-[3-(1,10-phenanthrolin-2-yl)phenyl]phenyl]phenyl]-1,10-phenanthroline
CID 134446086
3-(6H-benzo[c]chromen-10-yl)-6-[4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-3,6-dimethylcyclohexen-1-yl]-[1]benzothiolo[2,3-c]quinoline
CID 146489155
4-(1,4-dimethyl-4a,9b-dihydro-1H-dibenzofuran-4-yl)-6-[6-methyl-4-[4-[2-(1-methyl-2H-pyridin-2-yl)-6-pyridin-2-yl-4-pyridinyl]phenyl]cyclohexa-1,3-dien-1-yl]-5,6-dihydro-[1]benzothiolo[2,3-c]quinoline
CID 146489694
[3-[2-(9,9-Dimethylxanthen-4-yl)-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane
CID 155602094
[3-[2-(9,9-Dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane
CID 155602108
[3-[2-(9,9-Dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane
CID 155602112
[3-[2-(9,9-Dimethylxanthen-4-yl)-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl]phenyl]-triphenylsilane
CID 155602116
Bis[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl]phenyl]-diphenylsilane
CID 155602134
Iridium;15-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-4-id-1-yl]-43-[6-(4-triphenylen-2-ylphenyl)dibenzothiophen-4-yl]-6,9,12,18,21,24,34,37,40,46,49,52-dodecaoxa-15,43,67,70,85,88-hexazatridecacyclo[27.27.10.101,29.457,66.22,5.225,28.230,33.253,56.475,84.060,69.063,68.078,87.081,86]dononaconta-2(92),3,5(91),25(90),26,28(89),30,32,53(72),54,56(71),57(70),58,60(69),61,63(68),64,66,73,75(88),76,78(87),79,81(86),82,84-hexacosaene;2-phenylpyridine
CID 155646527

Frequently Asked Questions

What is the IUPAC name of [3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane?
The IUPAC name of [3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane (CID 159149938) is [3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane.
What is the SMILES notation for [3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane?
The canonical SMILES for [3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane is Cc1cccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-c3cc(-c4cccc5c4Oc4ccccc4C5(C)C)nc4c3ccc3c(-c5ccccc5)ccnc34)c2)c1.Cc1cccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-c3cc(-c4cccc5c4Oc4ccccc4C5(C)C)nc4c3ccc3cccnc34)c2)c1.Cc1cccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-c3cc(-c4cccc5c4sc4ccccc45)nc4c3ccc3c(-c5ccccc5)cc(-c5ccccn5)nc34)c2)c1.
What is the InChIKey of [3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane?
The InChIKey is KJDNBJYNQFGIOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H41N3SSi.C58H44N2OSi.C52H40N2OSi/c1-40-18-15-26-45(36-40)65(43-22-7-3-8-23-43,44-24-9-4-10-25-44)46-27-16-21-42(37-46)53-38-55(51-30-17-29-50-47-28-11-12-32-57(47)64-60(50)51)62-58-49(53)34-33-48-52(41-19-5-2-6-20-41)39-56(63-59(48)58)54-31-13-14-35-61-54;1-39-18-15-26-44(36-39)62(42-22-9-5-10-23-42,43-24-11-6-12-25-43)45-27-16-21-41(37-45)50-38-53(49-28-17-30-52-57(49)61-54-31-14-13-29-51(54)58(52,2)3)60-56-48(50)33-32-47-46(34-35-59-55(47)56)40-19-7-4-8-20-40;1-35-16-12-23-40(32-35)56(38-19-6-4-7-20-38,39-21-8-5-9-22-39)41-24-13-17-37(33-41)44-34-47(54-50-42(44)30-29-36-18-15-31-53-49(36)50)43-25-14-27-46-51(43)55-48-28-11-10-26-45(48)52(46,2)3/h2-39H,1H3;4-38H,1-3H3;4-34H,1-3H3.
What are the key properties of [3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane?
[3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane has a molecular weight of 2414.24 g/mol, XLogP of 35.04, 21 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-dibenzothiophen-4-yl-7-phenyl-9-pyridin-2-yl-1,10-phenanthrolin-4-yl)phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane;[3-[2-(9,9-dimethylxanthen-4-yl)-7-phenyl-1,10-phenanthrolin-4-yl]phenyl]-(3-methylphenyl)-diphenylsilane is sourced from PubChem (CID 159149938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).