4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline

C252H154N4O7S5 — CID 167691827

IUPAC4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline
SMILESc1ccc(-c2cccc3c2sc2ccccc23)c(-c2ccc(N(c3ccc(-c4cccc5oc6ccccc6c45)cc3)c3ccc(-c4cccc5sc6ccccc6c45)cc3)cc2)c1.c1ccc2c(c1)oc1c(-c3ccc4cc(-c5ccc(N(c6ccc(-c7cccc8oc9ccccc9c78)cc6)c6ccc(-c7cccc8sc9ccccc9c78)cc6)cc5)ccc4c3)cccc12.c1ccc2c(c1)oc1cccc(-c3ccc(N(c4ccc(-c5ccc(-c6cccc7oc8ccccc8c67)c6ccccc56)cc4)c4ccc(-c5cccc6sc7ccccc7c56)cc4)cc3)c12.c1ccc2c(c1)oc1cccc(-c3ccc(N(c4ccc(-c5ccc6cc(-c7cccc8oc9ccccc9c78)ccc6c5)cc4)c4ccc(-c5cccc6sc7ccccc7c56)cc4)cc3)c12
InChIInChI=1S/3C64H39NO2S.C60H37NOS2/c1-4-17-57-53(10-1)54-16-7-15-52(64(54)67-57)46-25-24-44-38-43(22-23-45(44)39-46)40-26-32-47(33-27-40)65(48-34-28-41(29-35-48)50-13-8-19-59-62(50)55-11-2-5-18-58(55)66-59)49-36-30-42(31-37-49)51-14-9-21-61-63(51)56-12-3-6-20-60(56)68-61;1-4-16-56-53(10-1)62-50(13-7-18-58(62)66-56)41-28-34-48(35-29-41)65(49-36-30-42(31-37-49)51-15-9-21-61-64(51)55-12-3-6-20-60(55)68-61)47-32-26-40(27-33-47)43-22-23-45-39-46(25-24-44(45)38-43)52-14-8-19-59-63(52)54-11-2-5-17-57(54)67-59;1-2-13-50-49(12-1)46(38-39-51(50)52-19-10-23-59-63(52)54-15-4-7-21-57(54)67-59)40-26-32-43(33-27-40)65(44-34-28-41(29-35-44)47-17-9-22-58-62(47)53-14-3-6-20-56(53)66-58)45-36-30-42(31-37-45)48-18-11-25-61-64(48)55-16-5-8-24-60(55)68-61;1-2-13-47(49-19-9-20-50-48-14-4-7-23-55(48)64-60(49)50)44(12-1)38-26-32-41(33-27-38)61(42-34-28-39(29-35-42)45-17-10-22-54-58(45)51-15-3-6-21-53(51)62-54)43-36-30-40(31-37-43)46-18-11-25-57-59(46)52-16-5-8-24-56(52)63-57/h3*1-39H;1-37H
InChIKeyXBFGEMLDOXIFHW-UHFFFAOYSA-N
MW3510.36 g/mol
LogP75.89
Rot. Bonds28

About 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline

4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline (PubChem CID 167691827) has the molecular formula C252H154N4O7S5 and a molecular weight of 3510.36 g/mol. Its IUPAC name is 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline.

Molecular Properties

Compound Name4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline
PubChem CID167691827
Molecular FormulaC252H154N4O7S5
Molecular Weight3510.36 g/mol
Exact Mass3507.04
IUPAC Name4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline
SMILESc1ccc(-c2cccc3c2sc2ccccc23)c(-c2ccc(N(c3ccc(-c4cccc5oc6ccccc6c45)cc3)c3ccc(-c4cccc5sc6ccccc6c45)cc3)cc2)c1.c1ccc2c(c1)oc1c(-c3ccc4cc(-c5ccc(N(c6ccc(-c7cccc8oc9ccccc9c78)cc6)c6ccc(-c7cccc8sc9ccccc9c78)cc6)cc5)ccc4c3)cccc12.c1ccc2c(c1)oc1cccc(-c3ccc(N(c4ccc(-c5ccc(-c6cccc7oc8ccccc8c67)c6ccccc56)cc4)c4ccc(-c5cccc6sc7ccccc7c56)cc4)cc3)c12.c1ccc2c(c1)oc1cccc(-c3ccc(N(c4ccc(-c5ccc6cc(-c7cccc8oc9ccccc9c78)ccc6c5)cc4)c4ccc(-c5cccc6sc7ccccc7c56)cc4)cc3)c12
InChIInChI=1S/3C64H39NO2S.C60H37NOS2/c1-4-17-57-53(10-1)54-16-7-15-52(64(54)67-57)46-25-24-44-38-43(22-23-45(44)39-46)40-26-32-47(33-27-40)65(48-34-28-41(29-35-48)50-13-8-19-59-62(50)55-11-2-5-18-58(55)66-59)49-36-30-42(31-37-49)51-14-9-21-61-63(51)56-12-3-6-20-60(56)68-61;1-4-16-56-53(10-1)62-50(13-7-18-58(62)66-56)41-28-34-48(35-29-41)65(49-36-30-42(31-37-49)51-15-9-21-61-64(51)55-12-3-6-20-60(55)68-61)47-32-26-40(27-33-47)43-22-23-45-39-46(25-24-44(45)38-43)52-14-8-19-59-63(52)54-11-2-5-17-57(54)67-59;1-2-13-50-49(12-1)46(38-39-51(50)52-19-10-23-59-63(52)54-15-4-7-21-57(54)67-59)40-26-32-43(33-27-40)65(44-34-28-41(29-35-44)47-17-9-22-58-62(47)53-14-3-6-20-56(53)66-58)45-36-30-42(31-37-45)48-18-11-25-61-64(48)55-16-5-8-24-60(55)68-61;1-2-13-47(49-19-9-20-50-48-14-4-7-23-55(48)64-60(49)50)44(12-1)38-26-32-41(33-27-38)61(42-34-28-39(29-35-42)45-17-10-22-54-58(45)51-15-3-6-21-53(51)62-54)43-36-30-40(31-37-43)46-18-11-25-57-59(46)52-16-5-8-24-56(52)63-57/h3*1-39H;1-37H
InChIKeyXBFGEMLDOXIFHW-UHFFFAOYSA-N
XLogP75.89
TPSA104.94 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds28
Heavy Atoms268
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003510.36
LogP ≤ 575.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline?
The IUPAC name of 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline (CID 167691827) is 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline.
What is the SMILES notation for 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline?
The canonical SMILES for 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline is c1ccc(-c2cccc3c2sc2ccccc23)c(-c2ccc(N(c3ccc(-c4cccc5oc6ccccc6c45)cc3)c3ccc(-c4cccc5sc6ccccc6c45)cc3)cc2)c1.c1ccc2c(c1)oc1c(-c3ccc4cc(-c5ccc(N(c6ccc(-c7cccc8oc9ccccc9c78)cc6)c6ccc(-c7cccc8sc9ccccc9c78)cc6)cc5)ccc4c3)cccc12.c1ccc2c(c1)oc1cccc(-c3ccc(N(c4ccc(-c5ccc(-c6cccc7oc8ccccc8c67)c6ccccc56)cc4)c4ccc(-c5cccc6sc7ccccc7c56)cc4)cc3)c12.c1ccc2c(c1)oc1cccc(-c3ccc(N(c4ccc(-c5ccc6cc(-c7cccc8oc9ccccc9c78)ccc6c5)cc4)c4ccc(-c5cccc6sc7ccccc7c56)cc4)cc3)c12.
What is the InChIKey of 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline?
The InChIKey is XBFGEMLDOXIFHW-UHFFFAOYSA-N. The full InChI is InChI=1S/3C64H39NO2S.C60H37NOS2/c1-4-17-57-53(10-1)54-16-7-15-52(64(54)67-57)46-25-24-44-38-43(22-23-45(44)39-46)40-26-32-47(33-27-40)65(48-34-28-41(29-35-48)50-13-8-19-59-62(50)55-11-2-5-18-58(55)66-59)49-36-30-42(31-37-49)51-14-9-21-61-63(51)56-12-3-6-20-60(56)68-61;1-4-16-56-53(10-1)62-50(13-7-18-58(62)66-56)41-28-34-48(35-29-41)65(49-36-30-42(31-37-49)51-15-9-21-61-64(51)55-12-3-6-20-60(55)68-61)47-32-26-40(27-33-47)43-22-23-45-39-46(25-24-44(45)38-43)52-14-8-19-59-63(52)54-11-2-5-17-57(54)67-59;1-2-13-50-49(12-1)46(38-39-51(50)52-19-10-23-59-63(52)54-15-4-7-21-57(54)67-59)40-26-32-43(33-27-40)65(44-34-28-41(29-35-44)47-17-9-22-58-62(47)53-14-3-6-20-56(53)66-58)45-36-30-42(31-37-45)48-18-11-25-61-64(48)55-16-5-8-24-60(55)68-61;1-2-13-47(49-19-9-20-50-48-14-4-7-23-55(48)64-60(49)50)44(12-1)38-26-32-41(33-27-38)61(42-34-28-39(29-35-42)45-17-10-22-54-58(45)51-15-3-6-21-53(51)62-54)43-36-30-40(31-37-43)46-18-11-25-57-59(46)52-16-5-8-24-56(52)63-57/h3*1-39H;1-37H.
What are the key properties of 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline?
4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline has a molecular weight of 3510.36 g/mol, XLogP of 75.89, 28 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-1-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-dibenzofuran-1-yl-N-(4-dibenzothiophen-1-ylphenyl)-N-[4-(2-dibenzothiophen-4-ylphenyl)phenyl]aniline;4-(6-dibenzofuran-1-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline;4-(6-dibenzofuran-4-ylnaphthalen-2-yl)-N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)aniline is sourced from PubChem (CID 167691827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).