12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole

C150H93FN6S3 — CID 159576095

IUPAC12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole
SMILESFc1ccc2sc3c(-c4ccc(-n5c6ccccc6c6ccc7c(c8ccccc8n7-c7ccccc7)c65)cc4)cccc3c2c1.c1ccc(-c2ccc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc(-c6ccc(-c7cccc8c7sc7ccccc78)cc6)cc5)c34)cc2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc(-c6ccc(-c7cccc8c7sc7ccccc78)cc6)cc5)c34)c2)cc1
InChIInChI=1S/2C54H34N2S.C42H25FN2S/c1-2-12-35(13-3-1)39-14-10-15-41(34-39)55-49-22-8-5-18-47(49)52-50(55)33-32-45-43-16-4-7-21-48(43)56(53(45)52)40-30-28-37(29-31-40)36-24-26-38(27-25-36)42-19-11-20-46-44-17-6-9-23-51(44)57-54(42)46;1-2-11-35(12-3-1)37-25-29-40(30-26-37)55-49-19-8-5-15-47(49)52-50(55)34-33-45-43-13-4-7-18-48(43)56(53(45)52)41-31-27-38(28-32-41)36-21-23-39(24-22-36)42-16-10-17-46-44-14-6-9-20-51(44)57-54(42)46;43-27-19-24-39-35(25-27)33-14-8-13-30(42(33)46-39)26-17-20-29(21-18-26)45-36-15-6-4-11-31(36)32-22-23-38-40(41(32)45)34-12-5-7-16-37(34)44(38)28-9-2-1-3-10-28/h2*1-34H;1-25H
InChIKeyMIKRMQKYEQBLFS-UHFFFAOYSA-N
MW2094.63 g/mol
LogP42.55
Rot. Bonds13

About 12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole

12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole (PubChem CID 159576095) has the molecular formula C150H93FN6S3 and a molecular weight of 2094.63 g/mol. Its IUPAC name is 12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole.

Molecular Properties

Compound Name12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole
PubChem CID159576095
Molecular FormulaC150H93FN6S3
Molecular Weight2094.63 g/mol
Exact Mass2092.66
IUPAC Name12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole
SMILESFc1ccc2sc3c(-c4ccc(-n5c6ccccc6c6ccc7c(c8ccccc8n7-c7ccccc7)c65)cc4)cccc3c2c1.c1ccc(-c2ccc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc(-c6ccc(-c7cccc8c7sc7ccccc78)cc6)cc5)c34)cc2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc(-c6ccc(-c7cccc8c7sc7ccccc78)cc6)cc5)c34)c2)cc1
InChIInChI=1S/2C54H34N2S.C42H25FN2S/c1-2-12-35(13-3-1)39-14-10-15-41(34-39)55-49-22-8-5-18-47(49)52-50(55)33-32-45-43-16-4-7-21-48(43)56(53(45)52)40-30-28-37(29-31-40)36-24-26-38(27-25-36)42-19-11-20-46-44-17-6-9-23-51(44)57-54(42)46;1-2-11-35(12-3-1)37-25-29-40(30-26-37)55-49-19-8-5-15-47(49)52-50(55)34-33-45-43-13-4-7-18-48(43)56(53(45)52)41-31-27-38(28-32-41)36-21-23-39(24-22-36)42-16-10-17-46-44-14-6-9-20-51(44)57-54(42)46;43-27-19-24-39-35(25-27)33-14-8-13-30(42(33)46-39)26-17-20-29(21-18-26)45-36-15-6-4-11-31(36)32-22-23-38-40(41(32)45)34-12-5-7-16-37(34)44(38)28-9-2-1-3-10-28/h2*1-34H;1-25H
InChIKeyMIKRMQKYEQBLFS-UHFFFAOYSA-N
XLogP42.55
TPSA29.58 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds13
Heavy Atoms160
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002094.63
LogP ≤ 542.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole with MolForge

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Related Compounds

12-(6-dibenzothiophen-4-yldibenzothiophen-2-yl)-5,9-diphenylindolo[3,2-c]carbazole
CID 146533062
5,12-bis(3-dibenzothiophen-4-ylphenyl)indolo[3,2-c]carbazole
CID 172515282
5-(3-dibenzothiophen-2-ylphenyl)-12-phenylindolo[3,2-c]carbazole
CID 118504656
7-(3-dibenzothiophen-4-ylphenyl)-5,12-diphenylindolo[3,2-a]carbazole;12-phenyl-5-(9-phenylcarbazol-3-yl)indolo[3,2-c]carbazole;5-phenyl-12-[4-(9-phenylcarbazol-3-yl)phenyl]indolo[3,2-c]carbazole
CID 159461030
12-dibenzothiophen-2-yl-5-[3-(3-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 171414705
16-(4-dibenzothiophen-4-ylphenyl)-12-phenyl-12,16-diazahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene;16-(4-dibenzothiophen-4-ylphenyl)-12-phenyl-12,16-diazahexacyclo[11.11.0.02,11.05,10.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene;5,12-diphenylindolo[3,2-c]carbazole;14-phenyl-3-(3-phenylphenyl)-3,14-diazahexacyclo[11.11.0.02,10.04,9.015,24.016,21]tetracosa-1(13),2(10),4,6,8,11,15(24),16,18,20,22-undecaene
CID 161350792
N-(4-dibenzothiophen-4-ylphenyl)-3-[3-(3-fluorocarbazol-9-yl)phenyl]-N-(4-phenylphenyl)aniline
CID 169073553
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
12-dibenzothiophen-2-yl-5-[4-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 122598840
12-phenyl-5-[3-[8-[8-[3-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]dibenzothiophen-2-yl]dibenzothiophen-2-yl]phenyl]indolo[3,2-c]carbazole
CID 118041194
5-(4-dibenzothiophen-4-ylphenyl)-11-phenyl-[1]benzothiolo[3,2-c]carbazole;2-phenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]-[1]benzothiolo[3,2-c]carbazole
CID 158127290
12-(6-dibenzothiophen-4-yldibenzothiophen-2-yl)-5-naphthalen-1-yl-9-phenylindolo[3,2-c]carbazole
CID 146532925

Frequently Asked Questions

What is the IUPAC name of 12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole?
The IUPAC name of 12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole (CID 159576095) is 12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole.
What is the SMILES notation for 12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole?
The canonical SMILES for 12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole is Fc1ccc2sc3c(-c4ccc(-n5c6ccccc6c6ccc7c(c8ccccc8n7-c7ccccc7)c65)cc4)cccc3c2c1.c1ccc(-c2ccc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc(-c6ccc(-c7cccc8c7sc7ccccc78)cc6)cc5)c34)cc2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc(-c6ccc(-c7cccc8c7sc7ccccc78)cc6)cc5)c34)c2)cc1.
What is the InChIKey of 12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole?
The InChIKey is MIKRMQKYEQBLFS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C54H34N2S.C42H25FN2S/c1-2-12-35(13-3-1)39-14-10-15-41(34-39)55-49-22-8-5-18-47(49)52-50(55)33-32-45-43-16-4-7-21-48(43)56(53(45)52)40-30-28-37(29-31-40)36-24-26-38(27-25-36)42-19-11-20-46-44-17-6-9-23-51(44)57-54(42)46;1-2-11-35(12-3-1)37-25-29-40(30-26-37)55-49-19-8-5-15-47(49)52-50(55)34-33-45-43-13-4-7-18-48(43)56(53(45)52)41-31-27-38(28-32-41)36-21-23-39(24-22-36)42-16-10-17-46-44-14-6-9-20-51(44)57-54(42)46;43-27-19-24-39-35(25-27)33-14-8-13-30(42(33)46-39)26-17-20-29(21-18-26)45-36-15-6-4-11-31(36)32-22-23-38-40(41(32)45)34-12-5-7-16-37(34)44(38)28-9-2-1-3-10-28/h2*1-34H;1-25H.
What are the key properties of 12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole?
12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole has a molecular weight of 2094.63 g/mol, XLogP of 42.55, 13 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(3-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(8-fluorodibenzothiophen-4-yl)phenyl]-5-phenylindolo[3,2-c]carbazole is sourced from PubChem (CID 159576095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).