[4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole

C146H96N6S3Si — CID 158950023

IUPAC[4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole
SMILESCc1ccc2c(c1)c1cc3c4ccccc4n(-c4ccccc4)c3cc1n2-c1ccc(-c2cccc3c2sc2ccccc23)cc1.Cc1ccc2c3cc4c5ccccc5n(-c5ccccc5)c4cc3n(-c3ccc(-c4cccc5c4sc4ccccc45)cc3)c2c1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccc(-c7cccc8c7sc7ccccc78)cc6)c5cc43)cc2)cc1
InChIInChI=1S/C60H40N2SSi.2C43H28N2S/c1-4-17-44(18-5-1)64(45-19-6-2-7-20-45,46-21-8-3-9-22-46)47-37-35-43(36-38-47)62-56-29-14-11-24-50(56)54-39-53-49-23-10-13-28-55(49)61(57(53)40-58(54)62)42-33-31-41(32-34-42)48-26-16-27-52-51-25-12-15-30-59(51)63-60(48)52;1-27-18-23-33-37-25-36-32-12-5-7-16-38(32)44(29-10-3-2-4-11-29)40(36)26-41(37)45(39(33)24-27)30-21-19-28(20-22-30)31-14-9-15-35-34-13-6-8-17-42(34)46-43(31)35;1-27-18-23-39-35(24-27)37-25-36-32-12-5-7-16-38(32)44(29-10-3-2-4-11-29)40(36)26-41(37)45(39)30-21-19-28(20-22-30)31-14-9-15-34-33-13-6-8-17-42(33)46-43(31)34/h1-40H;2*2-26H,1H3
InChIKeyJLHOPNVRTUITRH-UHFFFAOYSA-N
MW2058.70 g/mol
LogP37.74
Rot. Bonds13

About [4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole

[4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole (PubChem CID 158950023) has the molecular formula C146H96N6S3Si and a molecular weight of 2058.70 g/mol. Its IUPAC name is [4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole.

Molecular Properties

Compound Name[4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole
PubChem CID158950023
Molecular FormulaC146H96N6S3Si
Molecular Weight2058.70 g/mol
Exact Mass2056.66
IUPAC Name[4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole
SMILESCc1ccc2c(c1)c1cc3c4ccccc4n(-c4ccccc4)c3cc1n2-c1ccc(-c2cccc3c2sc2ccccc23)cc1.Cc1ccc2c3cc4c5ccccc5n(-c5ccccc5)c4cc3n(-c3ccc(-c4cccc5c4sc4ccccc45)cc3)c2c1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccc(-c7cccc8c7sc7ccccc78)cc6)c5cc43)cc2)cc1
InChIInChI=1S/C60H40N2SSi.2C43H28N2S/c1-4-17-44(18-5-1)64(45-19-6-2-7-20-45,46-21-8-3-9-22-46)47-37-35-43(36-38-47)62-56-29-14-11-24-50(56)54-39-53-49-23-10-13-28-55(49)61(57(53)40-58(54)62)42-33-31-41(32-34-42)48-26-16-27-52-51-25-12-15-30-59(51)63-60(48)52;1-27-18-23-33-37-25-36-32-12-5-7-16-38(32)44(29-10-3-2-4-11-29)40(36)26-41(37)45(39(33)24-27)30-21-19-28(20-22-30)31-14-9-15-35-34-13-6-8-17-42(34)46-43(31)35;1-27-18-23-39-35(24-27)37-25-36-32-12-5-7-16-38(32)44(29-10-3-2-4-11-29)40(36)26-41(37)45(39)30-21-19-28(20-22-30)31-14-9-15-34-33-13-6-8-17-42(33)46-43(31)34/h1-40H;2*2-26H,1H3
InChIKeyJLHOPNVRTUITRH-UHFFFAOYSA-N
XLogP37.74
TPSA29.58 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds13
Heavy Atoms156
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002058.70
LogP ≤ 537.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Related Compounds

3-dibenzothiophen-4-yl-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole;9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;triphenyl-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane
CID 164968186
3-dibenzothiophen-4-yl-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole;3-[9-(3-methylphenyl)carbazol-3-yl]-9-phenylcarbazole;9-(3-methylphenyl)-3-[9-(3-methylphenyl)carbazol-3-yl]carbazole;9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;triphenyl-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]silane;triphenyl-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane
CID 158245607
5-(4-dibenzothiophen-4-ylphenyl)-7-phenyl-2-(3-phenylphenyl)indolo[2,3-b]carbazole
CID 126579925
5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole;5,7-diphenylindolo[2,3-b]carbazole;9-phenyl-3-triphenylen-2-ylcarbazole;9-(3-triphenylen-2-ylphenyl)carbazole
CID 160956728
3-dibenzothiophen-4-yl-6-[9-(4-methylphenyl)carbazol-3-yl]-9-phenylcarbazole;2-phenyl-6-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-phenyl-6-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole
CID 159869296
3-[9-(4-dibenzothiophen-3-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-4-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 158400011
7-(4-dibenzothiophen-4-ylphenyl)-5-(4-phenanthren-9-ylphenyl)indolo[2,3-b]carbazole
CID 126579960
2-dibenzothiophen-4-yl-9-phenyl-6-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 129087238
3,9-bis(4-dibenzothiophen-4-ylphenyl)carbazole
CID 121449396
5-(4-dibenzothiophen-4-ylphenyl)-11-(2-phenylphenyl)indolo[3,2-b]carbazole
CID 126580053
[3-(3-carbazol-9-ylcarbazol-9-yl)-5-(3-dibenzothiophen-4-ylphenyl)phenyl]-triphenylsilane;[3-(3-carbazol-9-ylphenyl)-5-dibenzothiophen-4-ylphenyl]-triphenylsilane;[3-[3-(3-carbazol-9-ylphenyl)phenyl]-5-dibenzothiophen-4-ylphenyl]-triphenylsilane;[3-dibenzothiophen-4-yl-5-(9-phenylcarbazol-3-yl)phenyl]-triphenylsilane
CID 159703445
3-[9-(4-dibenzothiophen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-dibenzothiophen-2-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-(4-dibenzothiophen-4-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 159577303

Frequently Asked Questions

What is the IUPAC name of [4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole?
The IUPAC name of [4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole (CID 158950023) is [4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole.
What is the SMILES notation for [4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole?
The canonical SMILES for [4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole is Cc1ccc2c(c1)c1cc3c4ccccc4n(-c4ccccc4)c3cc1n2-c1ccc(-c2cccc3c2sc2ccccc23)cc1.Cc1ccc2c3cc4c5ccccc5n(-c5ccccc5)c4cc3n(-c3ccc(-c4cccc5c4sc4ccccc45)cc3)c2c1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccc(-c7cccc8c7sc7ccccc78)cc6)c5cc43)cc2)cc1.
What is the InChIKey of [4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole?
The InChIKey is JLHOPNVRTUITRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H40N2SSi.2C43H28N2S/c1-4-17-44(18-5-1)64(45-19-6-2-7-20-45,46-21-8-3-9-22-46)47-37-35-43(36-38-47)62-56-29-14-11-24-50(56)54-39-53-49-23-10-13-28-55(49)61(57(53)40-58(54)62)42-33-31-41(32-34-42)48-26-16-27-52-51-25-12-15-30-59(51)63-60(48)52;1-27-18-23-33-37-25-36-32-12-5-7-16-38(32)44(29-10-3-2-4-11-29)40(36)26-41(37)45(39(33)24-27)30-21-19-28(20-22-30)31-14-9-15-35-34-13-6-8-17-42(34)46-43(31)35;1-27-18-23-39-35(24-27)37-25-36-32-12-5-7-16-38(32)44(29-10-3-2-4-11-29)40(36)26-41(37)45(39)30-21-19-28(20-22-30)31-14-9-15-34-33-13-6-8-17-42(33)46-43(31)34/h1-40H;2*2-26H,1H3.
What are the key properties of [4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole?
[4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole has a molecular weight of 2058.70 g/mol, XLogP of 37.74, 13 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[7-(4-dibenzothiophen-4-ylphenyl)indolo[2,3-b]carbazol-5-yl]phenyl]-triphenylsilane;5-(4-dibenzothiophen-4-ylphenyl)-2-methyl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-3-methyl-7-phenylindolo[2,3-b]carbazole is sourced from PubChem (CID 158950023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).