N,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline

C187H119N3O4S2 — CID 159982609

IUPACN,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline
SMILESc1ccc(C2(c3cccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)c3)c3ccccc3-c3ccccc32)cc1.c1ccc(C2(c3cccc(N(c4ccc(-c5cccc6c5oc5ccccc56)cc4)c4ccc(-c5cccc6c5oc5ccccc56)c5ccccc45)c3)c3ccccc3-c3ccccc32)cc1.c1ccc(C2(c3cccc(N(c4ccc(-c5cccc6c5sc5ccccc56)cc4)c4ccc(-c5cccc6c5sc5ccccc56)cc4)c3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C65H41NO2.C61H39NO2.C61H39NS2/c1-2-17-43(18-3-1)65(58-31-10-6-22-50(58)51-23-7-11-32-59(51)65)44-19-14-20-46(41-44)66(45-37-35-42(36-38-45)47-27-15-29-56-53-25-8-12-33-61(53)67-63(47)56)60-40-39-49(48-21-4-5-24-52(48)60)55-28-16-30-57-54-26-9-13-34-62(54)68-64(55)57;1-2-14-43(15-3-1)61(55-24-8-4-18-49(55)50-19-5-9-25-56(50)61)44-16-12-17-47(39-44)62(45-33-28-40(29-34-45)42-32-37-59-54(38-42)52-21-7-10-26-57(52)63-59)46-35-30-41(31-36-46)48-22-13-23-53-51-20-6-11-27-58(51)64-60(48)53;1-2-15-42(16-3-1)61(55-27-8-4-19-49(55)50-20-5-9-28-56(50)61)43-17-12-18-46(39-43)62(44-35-31-40(32-36-44)47-23-13-25-53-51-21-6-10-29-57(51)63-59(47)53)45-37-33-41(34-38-45)48-24-14-26-54-52-22-7-11-30-58(52)64-60(48)54/h1-41H;2*1-39H
InChIKeyOFYQZQSVWCLMRL-UHFFFAOYSA-N
MW2536.16 g/mol
LogP52.05
Rot. Bonds21

About N,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline

N,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline (PubChem CID 159982609) has the molecular formula C187H119N3O4S2 and a molecular weight of 2536.16 g/mol. Its IUPAC name is N,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline.

Molecular Properties

Compound NameN,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline
PubChem CID159982609
Molecular FormulaC187H119N3O4S2
Molecular Weight2536.16 g/mol
Exact Mass2533.86
IUPAC NameN,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline
SMILESc1ccc(C2(c3cccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)c3)c3ccccc3-c3ccccc32)cc1.c1ccc(C2(c3cccc(N(c4ccc(-c5cccc6c5oc5ccccc56)cc4)c4ccc(-c5cccc6c5oc5ccccc56)c5ccccc45)c3)c3ccccc3-c3ccccc32)cc1.c1ccc(C2(c3cccc(N(c4ccc(-c5cccc6c5sc5ccccc56)cc4)c4ccc(-c5cccc6c5sc5ccccc56)cc4)c3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C65H41NO2.C61H39NO2.C61H39NS2/c1-2-17-43(18-3-1)65(58-31-10-6-22-50(58)51-23-7-11-32-59(51)65)44-19-14-20-46(41-44)66(45-37-35-42(36-38-45)47-27-15-29-56-53-25-8-12-33-61(53)67-63(47)56)60-40-39-49(48-21-4-5-24-52(48)60)55-28-16-30-57-54-26-9-13-34-62(54)68-64(55)57;1-2-14-43(15-3-1)61(55-24-8-4-18-49(55)50-19-5-9-25-56(50)61)44-16-12-17-47(39-44)62(45-33-28-40(29-34-45)42-32-37-59-54(38-42)52-21-7-10-26-57(52)63-59)46-35-30-41(31-36-46)48-22-13-23-53-51-20-6-11-27-58(51)64-60(48)53;1-2-15-42(16-3-1)61(55-27-8-4-19-49(55)50-20-5-9-28-56(50)61)43-17-12-18-46(39-43)62(44-35-31-40(32-36-44)47-23-13-25-53-51-21-6-10-29-57(51)63-59(47)53)45-37-33-41(34-38-45)48-24-14-26-54-52-22-7-11-30-58(52)64-60(48)54/h1-41H;2*1-39H
InChIKeyOFYQZQSVWCLMRL-UHFFFAOYSA-N
XLogP52.05
TPSA62.28 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds21
Heavy Atoms196
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002536.16
LogP ≤ 552.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze N,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline with MolForge

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Related Compounds

N-(4-dibenzofuran-4-ylphenyl)-3,5-diphenyl-N-[3-(9-phenylfluoren-9-yl)phenyl]aniline;N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)-N-[4-(3-phenylphenyl)phenyl]aniline;N-(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 161165341
N-(2-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(2-dibenzofuran-2-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(2-dibenzothiophen-2-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 159801227
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-dibenzothiophen-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine
CID 162198372
4-(3-dibenzofuran-4-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline
CID 121381304
N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-N-[4-(3-dibenzothiophen-4-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine
CID 121425117
N-(4-dibenzofuran-2-ylphenyl)-9,9-diphenyl-N-[2-(2-phenylphenyl)phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[2-(2-phenylphenyl)phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[2-(3-phenylphenyl)phenyl]fluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-9,9-diphenyl-N-[2-(2-phenylphenyl)phenyl]fluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-[2-(2-phenylphenyl)phenyl]fluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-[2-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 158243497
N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-N-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine
CID 121424800
N-(3-dibenzofuran-2-ylphenyl)-N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenylfluoren-3-amine;N-(3-dibenzofuran-4-ylphenyl)-N-(3-dibenzothiophen-2-ylphenyl)-9,9-diphenylfluoren-3-amine;N-(3-dibenzofuran-4-ylphenyl)-N-(3-dibenzothiophen-4-ylphenyl)-9,9-diphenylfluoren-3-amine
CID 158693483
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3-dibenzothiophen-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3-dibenzothiophen-4-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine
CID 158068867
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-4-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]dibenzothiophen-4-amine
CID 158701835
N-dibenzofuran-3-yl-N-[4-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]dibenzofuran-3-amine;N-phenyl-N-[4-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]dibenzofuran-4-amine;N-phenyl-N-[4-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]dibenzothiophen-4-amine
CID 159394304
N-(3-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-9,9-diphenylfluoren-4-amine
CID 121424235

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline?
The IUPAC name of N,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline (CID 159982609) is N,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline.
What is the SMILES notation for N,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline?
The canonical SMILES for N,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline is c1ccc(C2(c3cccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)c3)c3ccccc3-c3ccccc32)cc1.c1ccc(C2(c3cccc(N(c4ccc(-c5cccc6c5oc5ccccc56)cc4)c4ccc(-c5cccc6c5oc5ccccc56)c5ccccc45)c3)c3ccccc3-c3ccccc32)cc1.c1ccc(C2(c3cccc(N(c4ccc(-c5cccc6c5sc5ccccc56)cc4)c4ccc(-c5cccc6c5sc5ccccc56)cc4)c3)c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of N,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline?
The InChIKey is OFYQZQSVWCLMRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H41NO2.C61H39NO2.C61H39NS2/c1-2-17-43(18-3-1)65(58-31-10-6-22-50(58)51-23-7-11-32-59(51)65)44-19-14-20-46(41-44)66(45-37-35-42(36-38-45)47-27-15-29-56-53-25-8-12-33-61(53)67-63(47)56)60-40-39-49(48-21-4-5-24-52(48)60)55-28-16-30-57-54-26-9-13-34-62(54)68-64(55)57;1-2-14-43(15-3-1)61(55-24-8-4-18-49(55)50-19-5-9-25-56(50)61)44-16-12-17-47(39-44)62(45-33-28-40(29-34-45)42-32-37-59-54(38-42)52-21-7-10-26-57(52)63-59)46-35-30-41(31-36-46)48-22-13-23-53-51-20-6-11-27-58(51)64-60(48)53;1-2-15-42(16-3-1)61(55-27-8-4-19-49(55)50-20-5-9-28-56(50)61)43-17-12-18-46(39-43)62(44-35-31-40(32-36-44)47-23-13-25-53-51-21-6-10-29-57(51)63-59(47)53)45-37-33-41(34-38-45)48-24-14-26-54-52-22-7-11-30-58(52)64-60(48)54/h1-41H;2*1-39H.
What are the key properties of N,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline?
N,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline has a molecular weight of 2536.16 g/mol, XLogP of 52.05, 21 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-dibenzothiophen-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline;4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9-phenylfluoren-9-yl)aniline is sourced from PubChem (CID 159982609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).