2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine

C219H125N15O8S4 — CID 159359040

IUPAC2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine
SMILESc1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccc(-c6cccc7c6sc6ccccc67)c6c5oc5ccccc56)cc4)nc(-c4ccc5c(c4)oc4ccccc45)n3)c2)cc1.c1cncc(-c2ccc(-c3nc(-c4ccc(-c5ccc(-c6cccc7c6sc6ccccc67)c6c5oc5ccccc56)cc4)nc(-c4ccc5c(c4)oc4ccccc45)n3)cc2)c1.c1cncc(-c2ccccc2-c2nc(-c3ccc(-c4ccc(-c5cccc6c5sc5ccccc56)c5c4oc4ccccc45)cc3)nc(-c3ccc4c(c3)oc3ccccc34)n2)c1.c1cncc(-c2nc(-c3ccc(-c4ccc(-c5cccc6c5sc5ccccc56)c5c4oc4ccccc45)cc3)nc(-c3ccc4c(c3)oc3ccccc34)n2)c1
InChIInChI=1S/C57H33N3O2S.2C56H32N4O2S.C50H28N4O2S/c1-2-12-34(13-3-1)37-14-10-15-38(32-37)56-58-55(59-57(60-56)39-28-29-42-41-16-4-7-21-48(41)61-50(42)33-39)36-26-24-35(25-27-36)40-30-31-44(52-47-18-5-8-22-49(47)62-53(40)52)46-20-11-19-45-43-17-6-9-23-51(43)63-54(45)46;1-4-15-47-40(10-1)41-27-26-37(31-49(41)61-47)56-59-54(35-22-18-33(19-23-35)38-9-8-30-57-32-38)58-55(60-56)36-24-20-34(21-25-36)39-28-29-43(51-46-12-2-5-16-48(46)62-52(39)51)45-14-7-13-44-42-11-3-6-17-50(42)63-53(44)45;1-2-15-45(37(12-1)36-11-10-30-57-32-36)56-59-54(58-55(60-56)35-26-27-40-39-13-3-6-19-47(39)61-49(40)31-35)34-24-22-33(23-25-34)38-28-29-42(51-46-16-4-7-20-48(46)62-52(38)51)44-18-9-17-43-41-14-5-8-21-50(41)63-53(43)44;1-4-15-41-34(10-1)35-23-22-31(27-43(35)55-41)49-52-48(53-50(54-49)32-9-8-26-51-28-32)30-20-18-29(19-21-30)33-24-25-37(45-40-12-2-5-16-42(40)56-46(33)45)39-14-7-13-38-36-11-3-6-17-44(36)57-47(38)39/h1-33H;2*1-32H;1-28H
InChIKeyLIHIPOPIEIZKRZ-UHFFFAOYSA-N
MW3222.77 g/mol
LogP60.68
Rot. Bonds23

About 2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine

2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine (PubChem CID 159359040) has the molecular formula C219H125N15O8S4 and a molecular weight of 3222.77 g/mol. Its IUPAC name is 2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine.

Molecular Properties

Compound Name2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine
PubChem CID159359040
Molecular FormulaC219H125N15O8S4
Molecular Weight3222.77 g/mol
Exact Mass3219.87
IUPAC Name2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine
SMILESc1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccc(-c6cccc7c6sc6ccccc67)c6c5oc5ccccc56)cc4)nc(-c4ccc5c(c4)oc4ccccc45)n3)c2)cc1.c1cncc(-c2ccc(-c3nc(-c4ccc(-c5ccc(-c6cccc7c6sc6ccccc67)c6c5oc5ccccc56)cc4)nc(-c4ccc5c(c4)oc4ccccc45)n3)cc2)c1.c1cncc(-c2ccccc2-c2nc(-c3ccc(-c4ccc(-c5cccc6c5sc5ccccc56)c5c4oc4ccccc45)cc3)nc(-c3ccc4c(c3)oc3ccccc34)n2)c1.c1cncc(-c2nc(-c3ccc(-c4ccc(-c5cccc6c5sc5ccccc56)c5c4oc4ccccc45)cc3)nc(-c3ccc4c(c3)oc3ccccc34)n2)c1
InChIInChI=1S/C57H33N3O2S.2C56H32N4O2S.C50H28N4O2S/c1-2-12-34(13-3-1)37-14-10-15-38(32-37)56-58-55(59-57(60-56)39-28-29-42-41-16-4-7-21-48(41)61-50(42)33-39)36-26-24-35(25-27-36)40-30-31-44(52-47-18-5-8-22-49(47)62-53(40)52)46-20-11-19-45-43-17-6-9-23-51(43)63-54(45)46;1-4-15-47-40(10-1)41-27-26-37(31-49(41)61-47)56-59-54(35-22-18-33(19-23-35)38-9-8-30-57-32-38)58-55(60-56)36-24-20-34(21-25-36)39-28-29-43(51-46-12-2-5-16-48(46)62-52(39)51)45-14-7-13-44-42-11-3-6-17-50(42)63-53(44)45;1-2-15-45(37(12-1)36-11-10-30-57-32-36)56-59-54(58-55(60-56)35-26-27-40-39-13-3-6-19-47(39)61-49(40)31-35)34-24-22-33(23-25-34)38-28-29-42(51-46-16-4-7-20-48(46)62-52(38)51)44-18-9-17-43-41-14-5-8-21-50(41)63-53(43)44;1-4-15-41-34(10-1)35-23-22-31(27-43(35)55-41)49-52-48(53-50(54-49)32-9-8-26-51-28-32)30-20-18-29(19-21-30)33-24-25-37(45-40-12-2-5-16-42(40)56-46(33)45)39-14-7-13-38-36-11-3-6-17-44(36)57-47(38)39/h1-33H;2*1-32H;1-28H
InChIKeyLIHIPOPIEIZKRZ-UHFFFAOYSA-N
XLogP60.68
TPSA298.47 Ų
H-Bond Donors
H-Bond Acceptors27
Rotatable Bonds23
Heavy Atoms246
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003222.77
LogP ≤ 560.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1027

Analyze 2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine?
The IUPAC name of 2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine (CID 159359040) is 2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine.
What is the SMILES notation for 2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine?
The canonical SMILES for 2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine is c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccc(-c6cccc7c6sc6ccccc67)c6c5oc5ccccc56)cc4)nc(-c4ccc5c(c4)oc4ccccc45)n3)c2)cc1.c1cncc(-c2ccc(-c3nc(-c4ccc(-c5ccc(-c6cccc7c6sc6ccccc67)c6c5oc5ccccc56)cc4)nc(-c4ccc5c(c4)oc4ccccc45)n3)cc2)c1.c1cncc(-c2ccccc2-c2nc(-c3ccc(-c4ccc(-c5cccc6c5sc5ccccc56)c5c4oc4ccccc45)cc3)nc(-c3ccc4c(c3)oc3ccccc34)n2)c1.c1cncc(-c2nc(-c3ccc(-c4ccc(-c5cccc6c5sc5ccccc56)c5c4oc4ccccc45)cc3)nc(-c3ccc4c(c3)oc3ccccc34)n2)c1.
What is the InChIKey of 2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine?
The InChIKey is LIHIPOPIEIZKRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H33N3O2S.2C56H32N4O2S.C50H28N4O2S/c1-2-12-34(13-3-1)37-14-10-15-38(32-37)56-58-55(59-57(60-56)39-28-29-42-41-16-4-7-21-48(41)61-50(42)33-39)36-26-24-35(25-27-36)40-30-31-44(52-47-18-5-8-22-49(47)62-53(40)52)46-20-11-19-45-43-17-6-9-23-51(43)63-54(45)46;1-4-15-47-40(10-1)41-27-26-37(31-49(41)61-47)56-59-54(35-22-18-33(19-23-35)38-9-8-30-57-32-38)58-55(60-56)36-24-20-34(21-25-36)39-28-29-43(51-46-12-2-5-16-48(46)62-52(39)51)45-14-7-13-44-42-11-3-6-17-50(42)63-53(44)45;1-2-15-45(37(12-1)36-11-10-30-57-32-36)56-59-54(58-55(60-56)35-26-27-40-39-13-3-6-19-47(39)61-49(40)31-35)34-24-22-33(23-25-34)38-28-29-42(51-46-16-4-7-20-48(46)62-52(38)51)44-18-9-17-43-41-14-5-8-21-50(41)63-53(43)44;1-4-15-41-34(10-1)35-23-22-31(27-43(35)55-41)49-52-48(53-50(54-49)32-9-8-26-51-28-32)30-20-18-29(19-21-30)33-24-25-37(45-40-12-2-5-16-42(40)56-46(33)45)39-14-7-13-38-36-11-3-6-17-44(36)57-47(38)39/h1-33H;2*1-32H;1-28H.
What are the key properties of 2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine?
2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine has a molecular weight of 3222.77 g/mol, XLogP of 60.68, 23 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(1-dibenzothiophen-4-yldibenzofuran-4-yl)phenyl]-6-pyridin-3-yl-1,3,5-triazine is sourced from PubChem (CID 159359040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).