4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline

C182H118N4OS6 — CID 158126974

IUPAC4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3cccc(-c4ccc5sc6ccccc6c5c4)c3)c3cccc(-c4ccc5sc6ccccc6c5c4)c3)cc2)cc1.c1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3cccc(-c4ccc5sc6ccccc6c5c4)c3)cc2)cc1.c1ccc2c(-c3ccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4ccc(-c5ccc6sc7ccccc7c6c5)cc4)cc3)cccc2c1.c1ccc2c(N(c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)c3ccc4sc5ccccc5c4c3)cccc2c1
InChIInChI=1S/C52H33NOS.C48H31NS2.C42H29NS.C40H25NS2/c1-2-10-43-36(8-1)9-7-13-44(43)37-20-28-42(29-21-37)53(40-24-16-34(17-25-40)38-22-30-50-47(32-38)45-11-3-5-14-49(45)54-50)41-26-18-35(19-27-41)39-23-31-52-48(33-39)46-12-4-6-15-51(46)55-52;1-2-10-32(11-3-1)33-20-24-38(25-21-33)49(39-14-8-12-34(28-39)36-22-26-47-43(30-36)41-16-4-6-18-45(41)50-47)40-15-9-13-35(29-40)37-23-27-48-44(31-37)42-17-5-7-19-46(42)51-48;1-3-11-30(12-4-1)32-21-24-36(25-22-32)43(37-17-9-15-33(27-37)31-13-5-2-6-14-31)38-18-10-16-34(28-38)35-23-26-42-40(29-35)39-19-7-8-20-41(39)44-42;1-2-10-31-27(8-1)9-7-13-36(31)41(30-21-23-40-35(25-30)33-12-4-6-15-38(33)43-40)29-19-16-26(17-20-29)28-18-22-39-34(24-28)32-11-3-5-14-37(32)42-39/h1-33H;1-31H;1-29H;1-25H
InChIKeyFSHLEOBPSNERTH-UHFFFAOYSA-N
MW2569.37 g/mol
LogP55.71
Rot. Bonds22

About 4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline

4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline (PubChem CID 158126974) has the molecular formula C182H118N4OS6 and a molecular weight of 2569.37 g/mol. Its IUPAC name is 4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline.

Molecular Properties

Compound Name4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline
PubChem CID158126974
Molecular FormulaC182H118N4OS6
Molecular Weight2569.37 g/mol
Exact Mass2566.76
IUPAC Name4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3cccc(-c4ccc5sc6ccccc6c5c4)c3)c3cccc(-c4ccc5sc6ccccc6c5c4)c3)cc2)cc1.c1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3cccc(-c4ccc5sc6ccccc6c5c4)c3)cc2)cc1.c1ccc2c(-c3ccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4ccc(-c5ccc6sc7ccccc7c6c5)cc4)cc3)cccc2c1.c1ccc2c(N(c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)c3ccc4sc5ccccc5c4c3)cccc2c1
InChIInChI=1S/C52H33NOS.C48H31NS2.C42H29NS.C40H25NS2/c1-2-10-43-36(8-1)9-7-13-44(43)37-20-28-42(29-21-37)53(40-24-16-34(17-25-40)38-22-30-50-47(32-38)45-11-3-5-14-49(45)54-50)41-26-18-35(19-27-41)39-23-31-52-48(33-39)46-12-4-6-15-51(46)55-52;1-2-10-32(11-3-1)33-20-24-38(25-21-33)49(39-14-8-12-34(28-39)36-22-26-47-43(30-36)41-16-4-6-18-45(41)50-47)40-15-9-13-35(29-40)37-23-27-48-44(31-37)42-17-5-7-19-46(42)51-48;1-3-11-30(12-4-1)32-21-24-36(25-22-32)43(37-17-9-15-33(27-37)31-13-5-2-6-14-31)38-18-10-16-34(28-38)35-23-26-42-40(29-35)39-19-7-8-20-41(39)44-42;1-2-10-31-27(8-1)9-7-13-36(31)41(30-21-23-40-35(25-30)33-12-4-6-15-38(33)43-40)29-19-16-26(17-20-29)28-18-22-39-34(24-28)32-11-3-5-14-37(32)42-39/h1-33H;1-31H;1-29H;1-25H
InChIKeyFSHLEOBPSNERTH-UHFFFAOYSA-N
XLogP55.71
TPSA26.10 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds22
Heavy Atoms193
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002569.37
LogP ≤ 555.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline?
The IUPAC name of 4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline (CID 158126974) is 4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline.
What is the SMILES notation for 4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline?
The canonical SMILES for 4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline is c1ccc(-c2ccc(N(c3cccc(-c4ccc5sc6ccccc6c5c4)c3)c3cccc(-c4ccc5sc6ccccc6c5c4)c3)cc2)cc1.c1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3cccc(-c4ccc5sc6ccccc6c5c4)c3)cc2)cc1.c1ccc2c(-c3ccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4ccc(-c5ccc6sc7ccccc7c6c5)cc4)cc3)cccc2c1.c1ccc2c(N(c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)c3ccc4sc5ccccc5c4c3)cccc2c1.
What is the InChIKey of 4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline?
The InChIKey is FSHLEOBPSNERTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H33NOS.C48H31NS2.C42H29NS.C40H25NS2/c1-2-10-43-36(8-1)9-7-13-44(43)37-20-28-42(29-21-37)53(40-24-16-34(17-25-40)38-22-30-50-47(32-38)45-11-3-5-14-49(45)54-50)41-26-18-35(19-27-41)39-23-31-52-48(33-39)46-12-4-6-15-51(46)55-52;1-2-10-32(11-3-1)33-20-24-38(25-21-33)49(39-14-8-12-34(28-39)36-22-26-47-43(30-36)41-16-4-6-18-45(41)50-47)40-15-9-13-35(29-40)37-23-27-48-44(31-37)42-17-5-7-19-46(42)51-48;1-3-11-30(12-4-1)32-21-24-36(25-22-32)43(37-17-9-15-33(27-37)31-13-5-2-6-14-31)38-18-10-16-34(28-38)35-23-26-42-40(29-35)39-19-7-8-20-41(39)44-42;1-2-10-31-27(8-1)9-7-13-36(31)41(30-21-23-40-35(25-30)33-12-4-6-15-38(33)43-40)29-19-16-26(17-20-29)28-18-22-39-34(24-28)32-11-3-5-14-37(32)42-39/h1-33H;1-31H;1-29H;1-25H.
What are the key properties of 4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline?
4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline has a molecular weight of 2569.37 g/mol, XLogP of 55.71, 22 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline is sourced from PubChem (CID 158126974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).