N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline

C192H123N3O2S4 — CID 158373049

IUPACN-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline
SMILESCC1(c2cccc(N(c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)c3ccc(-c4cccc5c4sc4ccccc45)cc3)c2)c2ccccc2-c2ccccc21.c1cc(N(c2ccc(-c3ccc4oc5ccccc5c4c3)cc2)c2ccc(-c3cccc4c3sc3ccccc34)cc2)cc(C2(c3ccc4ccccc4c3)c3ccccc3-c3ccccc32)c1.c1ccc(-c2cccc(C3(c4cccc(N(c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)c5ccc6cc(-c7cccc8c7sc7ccccc78)ccc6c5)c4)c4ccccc4-c4ccccc43)c2)cc1
InChIInChI=1S/C71H45NOS.C65H41NOS.C56H37NS2/c1-2-15-46(16-3-1)48-17-12-18-53(42-48)71(65-27-8-4-21-59(65)60-22-5-9-28-66(60)71)54-19-13-20-56(45-54)72(55-37-33-47(34-38-55)51-36-40-68-64(44-51)61-23-6-10-29-67(61)73-68)57-39-35-49-41-52(32-31-50(49)43-57)58-25-14-26-63-62-24-7-11-30-69(62)74-70(58)63;1-2-14-45-39-48(33-27-42(45)13-1)65(59-23-7-3-17-53(59)54-18-4-8-24-60(54)65)47-15-11-16-51(41-47)66(49-34-28-43(29-35-49)46-32-38-62-58(40-46)55-19-5-9-25-61(55)67-62)50-36-30-44(31-37-50)52-21-12-22-57-56-20-6-10-26-63(56)68-64(52)57;1-56(50-20-6-2-14-44(50)45-15-3-7-21-51(45)56)39-12-10-13-42(35-39)57(40-29-24-36(25-30-40)38-28-33-54-49(34-38)47-17-5-8-22-52(47)58-54)41-31-26-37(27-32-41)43-18-11-19-48-46-16-4-9-23-53(46)59-55(43)48/h1-45H;1-41H;2-35H,1H3
InChIKeyGUVYADCAYXIDLQ-UHFFFAOYSA-N
MW2632.38 g/mol
LogP54.78
Rot. Bonds21

About N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline

N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline (PubChem CID 158373049) has the molecular formula C192H123N3O2S4 and a molecular weight of 2632.38 g/mol. Its IUPAC name is N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline.

Molecular Properties

Compound NameN-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline
PubChem CID158373049
Molecular FormulaC192H123N3O2S4
Molecular Weight2632.38 g/mol
Exact Mass2629.85
IUPAC NameN-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline
SMILESCC1(c2cccc(N(c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)c3ccc(-c4cccc5c4sc4ccccc45)cc3)c2)c2ccccc2-c2ccccc21.c1cc(N(c2ccc(-c3ccc4oc5ccccc5c4c3)cc2)c2ccc(-c3cccc4c3sc3ccccc34)cc2)cc(C2(c3ccc4ccccc4c3)c3ccccc3-c3ccccc32)c1.c1ccc(-c2cccc(C3(c4cccc(N(c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)c5ccc6cc(-c7cccc8c7sc7ccccc78)ccc6c5)c4)c4ccccc4-c4ccccc43)c2)cc1
InChIInChI=1S/C71H45NOS.C65H41NOS.C56H37NS2/c1-2-15-46(16-3-1)48-17-12-18-53(42-48)71(65-27-8-4-21-59(65)60-22-5-9-28-66(60)71)54-19-13-20-56(45-54)72(55-37-33-47(34-38-55)51-36-40-68-64(44-51)61-23-6-10-29-67(61)73-68)57-39-35-49-41-52(32-31-50(49)43-57)58-25-14-26-63-62-24-7-11-30-69(62)74-70(58)63;1-2-14-45-39-48(33-27-42(45)13-1)65(59-23-7-3-17-53(59)54-18-4-8-24-60(54)65)47-15-11-16-51(41-47)66(49-34-28-43(29-35-49)46-32-38-62-58(40-46)55-19-5-9-25-61(55)67-62)50-36-30-44(31-37-50)52-21-12-22-57-56-20-6-10-26-63(56)68-64(52)57;1-56(50-20-6-2-14-44(50)45-15-3-7-21-51(45)56)39-12-10-13-42(35-39)57(40-29-24-36(25-30-40)38-28-33-54-49(34-38)47-17-5-8-22-52(47)58-54)41-31-26-37(27-32-41)43-18-11-19-48-46-16-4-9-23-53(46)59-55(43)48/h1-45H;1-41H;2-35H,1H3
InChIKeyGUVYADCAYXIDLQ-UHFFFAOYSA-N
XLogP54.78
TPSA36.00 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds21
Heavy Atoms201
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002632.38
LogP ≤ 554.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline?
The IUPAC name of N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline (CID 158373049) is N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline.
What is the SMILES notation for N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline?
The canonical SMILES for N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline is CC1(c2cccc(N(c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)c3ccc(-c4cccc5c4sc4ccccc45)cc3)c2)c2ccccc2-c2ccccc21.c1cc(N(c2ccc(-c3ccc4oc5ccccc5c4c3)cc2)c2ccc(-c3cccc4c3sc3ccccc34)cc2)cc(C2(c3ccc4ccccc4c3)c3ccccc3-c3ccccc32)c1.c1ccc(-c2cccc(C3(c4cccc(N(c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)c5ccc6cc(-c7cccc8c7sc7ccccc78)ccc6c5)c4)c4ccccc4-c4ccccc43)c2)cc1.
What is the InChIKey of N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline?
The InChIKey is GUVYADCAYXIDLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C71H45NOS.C65H41NOS.C56H37NS2/c1-2-15-46(16-3-1)48-17-12-18-53(42-48)71(65-27-8-4-21-59(65)60-22-5-9-28-66(60)71)54-19-13-20-56(45-54)72(55-37-33-47(34-38-55)51-36-40-68-64(44-51)61-23-6-10-29-67(61)73-68)57-39-35-49-41-52(32-31-50(49)43-57)58-25-14-26-63-62-24-7-11-30-69(62)74-70(58)63;1-2-14-45-39-48(33-27-42(45)13-1)65(59-23-7-3-17-53(59)54-18-4-8-24-60(54)65)47-15-11-16-51(41-47)66(49-34-28-43(29-35-49)46-32-38-62-58(40-46)55-19-5-9-25-61(55)67-62)50-36-30-44(31-37-50)52-21-12-22-57-56-20-6-10-26-63(56)68-64(52)57;1-56(50-20-6-2-14-44(50)45-15-3-7-21-51(45)56)39-12-10-13-42(35-39)57(40-29-24-36(25-30-40)38-28-33-54-49(34-38)47-17-5-8-22-52(47)58-54)41-31-26-37(27-32-41)43-18-11-19-48-46-16-4-9-23-53(46)59-55(43)48/h1-45H;1-41H;2-35H,1H3.
What are the key properties of N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline?
N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline has a molecular weight of 2632.38 g/mol, XLogP of 54.78, 21 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-naphthalen-2-ylfluoren-9-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6-dibenzothiophen-4-yl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]naphthalen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3-(9-methylfluoren-9-yl)aniline is sourced from PubChem (CID 158373049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).