3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine

C186H123N7S3 — CID 158114266

IUPAC3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine
SMILESc1ccc(-c2ccc(N(c3ccccc3)c3cccc(-c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6sc7ccccc7c56)c4)c3)c(-c3ccccc3)c2)cc1.c1ccc(N(c2cccc(-c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4cccc5c4sc4ccccc45)c3)c2)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1.c1ccc(N(c2cccc(-c3cccc(-c4cccnc4)c3)c2)c2cccc(-c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5sc6ccccc6c5c4)c3)c2)cc1
InChIInChI=1S/C67H44N2S.C60H40N2S.C59H39N3S/c1-4-22-49(23-5-1)67(50-24-6-2-7-25-50)60-33-13-10-29-54(60)55-39-38-53(44-61(55)67)68(51-26-8-3-9-27-51)52-28-17-21-47(42-52)45-19-16-20-46(41-45)48-37-40-63-59(43-48)56-30-11-14-34-62(56)69(63)64-35-18-32-58-57-31-12-15-36-65(57)70-66(58)64;1-4-17-41(18-5-1)46-33-35-55(52(39-46)42-19-6-2-7-20-42)61(48-24-8-3-9-25-48)49-26-15-23-45(38-49)43-21-14-22-44(37-43)47-34-36-56-53(40-47)50-27-10-12-29-54(50)62(56)57-30-16-32-59-60(57)51-28-11-13-31-58(51)63-59;1-2-20-48(21-3-1)61(50-23-11-18-45(36-50)41-14-9-16-43(34-41)47-19-12-32-60-39-47)49-22-10-17-44(35-49)40-13-8-15-42(33-40)46-28-30-57-54(37-46)52-24-4-6-26-56(52)62(57)51-29-31-59-55(38-51)53-25-5-7-27-58(53)63-59/h1-44H;1-40H;1-39H
InChIKeyFQUPQTLFCFPXCJ-UHFFFAOYSA-N
MW2552.28 g/mol
LogP52.29
Rot. Bonds24

About 3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine

3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine (PubChem CID 158114266) has the molecular formula C186H123N7S3 and a molecular weight of 2552.28 g/mol. Its IUPAC name is 3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine.

Molecular Properties

Compound Name3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine
PubChem CID158114266
Molecular FormulaC186H123N7S3
Molecular Weight2552.28 g/mol
Exact Mass2549.90
IUPAC Name3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine
SMILESc1ccc(-c2ccc(N(c3ccccc3)c3cccc(-c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6sc7ccccc7c56)c4)c3)c(-c3ccccc3)c2)cc1.c1ccc(N(c2cccc(-c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4cccc5c4sc4ccccc45)c3)c2)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1.c1ccc(N(c2cccc(-c3cccc(-c4cccnc4)c3)c2)c2cccc(-c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5sc6ccccc6c5c4)c3)c2)cc1
InChIInChI=1S/C67H44N2S.C60H40N2S.C59H39N3S/c1-4-22-49(23-5-1)67(50-24-6-2-7-25-50)60-33-13-10-29-54(60)55-39-38-53(44-61(55)67)68(51-26-8-3-9-27-51)52-28-17-21-47(42-52)45-19-16-20-46(41-45)48-37-40-63-59(43-48)56-30-11-14-34-62(56)69(63)64-35-18-32-58-57-31-12-15-36-65(57)70-66(58)64;1-4-17-41(18-5-1)46-33-35-55(52(39-46)42-19-6-2-7-20-42)61(48-24-8-3-9-25-48)49-26-15-23-45(38-49)43-21-14-22-44(37-43)47-34-36-56-53(40-47)50-27-10-12-29-54(50)62(56)57-30-16-32-59-60(57)51-28-11-13-31-58(51)63-59;1-2-20-48(21-3-1)61(50-23-11-18-45(36-50)41-14-9-16-43(34-41)47-19-12-32-60-39-47)49-22-10-17-44(35-49)40-13-8-15-42(33-40)46-28-30-57-54(37-46)52-24-4-6-26-56(52)62(57)51-29-31-59-55(38-51)53-25-5-7-27-58(53)63-59/h1-44H;1-40H;1-39H
InChIKeyFQUPQTLFCFPXCJ-UHFFFAOYSA-N
XLogP52.29
TPSA37.40 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds24
Heavy Atoms196
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002552.28
LogP ≤ 552.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine with MolForge

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Related Compounds

N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine
CID 118462505
N-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 118086604
N-(9,9-diphenylfluoren-2-yl)-N-[4-[3-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]phenyl]dibenzothiophen-2-amine
CID 89426464
N-[4-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)triphenylen-2-amine;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 159641615
N-(4-dibenzothiophen-4-ylphenyl)-4-[6-(9,9-diphenylfluoren-2-yl)-9-triphenylen-2-ylcarbazol-3-yl]-N-phenylaniline
CID 89492150
N-[4-[3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-3-amine;N-[4-[3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]phenyl]phenyl]-N,4-diphenylaniline;N-phenyl-N-(4-pyridin-3-ylphenyl)-4-[3-[9-(9,9'-spirobi[fluorene]-2-yl)carbazol-3-yl]phenyl]aniline
CID 158025945
9-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)dibenzothiophen-4-amine
CID 90371969
N-(4-dibenzothiophen-4-ylphenyl)-N-(2,4-diphenylphenyl)-9,9-diphenylfluoren-2-amine
CID 122675309
N-[3-(4-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzothiophen-4-ylphenyl)-9,9-diphenylfluoren-3-amine
CID 121424709
N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine
CID 162233532
N,N-bis(4-dibenzothiophen-4-ylphenyl)-9,9-diphenylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-2-ylphenyl)-9,9-diphenylfluoren-2-amine
CID 158676127
N-[3-[3-(9-dibenzothiophen-3-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-3-amine
CID 118462496

Frequently Asked Questions

What is the IUPAC name of 3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine?
The IUPAC name of 3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine (CID 158114266) is 3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine.
What is the SMILES notation for 3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine?
The canonical SMILES for 3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine is c1ccc(-c2ccc(N(c3ccccc3)c3cccc(-c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6sc7ccccc7c56)c4)c3)c(-c3ccccc3)c2)cc1.c1ccc(N(c2cccc(-c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4cccc5c4sc4ccccc45)c3)c2)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1.c1ccc(N(c2cccc(-c3cccc(-c4cccnc4)c3)c2)c2cccc(-c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5sc6ccccc6c5c4)c3)c2)cc1.
What is the InChIKey of 3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine?
The InChIKey is FQUPQTLFCFPXCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H44N2S.C60H40N2S.C59H39N3S/c1-4-22-49(23-5-1)67(50-24-6-2-7-25-50)60-33-13-10-29-54(60)55-39-38-53(44-61(55)67)68(51-26-8-3-9-27-51)52-28-17-21-47(42-52)45-19-16-20-46(41-45)48-37-40-63-59(43-48)56-30-11-14-34-62(56)69(63)64-35-18-32-58-57-31-12-15-36-65(57)70-66(58)64;1-4-17-41(18-5-1)46-33-35-55(52(39-46)42-19-6-2-7-20-42)61(48-24-8-3-9-25-48)49-26-15-23-45(38-49)43-21-14-22-44(37-43)47-34-36-56-53(40-47)50-27-10-12-29-54(50)62(56)57-30-16-32-59-60(57)51-28-11-13-31-58(51)63-59;1-2-20-48(21-3-1)61(50-23-11-18-45(36-50)41-14-9-16-43(34-41)47-19-12-32-60-39-47)49-22-10-17-44(35-49)40-13-8-15-42(33-40)46-28-30-57-54(37-46)52-24-4-6-26-56(52)62(57)51-29-31-59-55(38-51)53-25-5-7-27-58(53)63-59/h1-44H;1-40H;1-39H.
What are the key properties of 3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine?
3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine has a molecular weight of 2552.28 g/mol, XLogP of 52.29, 24 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-N-phenyl-N-[3-(3-pyridin-3-ylphenyl)phenyl]aniline;N-[3-[3-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]phenyl]-N,2,4-triphenylaniline;N-[3-[3-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine is sourced from PubChem (CID 158114266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).