2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine

C216H136N20O4 — CID 159831160

IUPAC2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4cc5c(cc4-c4nc(-c6ccccc6)nc(-c6ccccc6)n4)oc4ccccc45)c3)n2)cc1.c1ccc(-c2ccc(-c3ccc(-c4cc5oc6ccccc6c5cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)nn2)cc1.c1ccc(-c2cccc(-c3cc(-c4ccc(-c5cc6c(cc5-c5ccc(-c7cc(-c8ccccc8)nc(-c8ccccc8)n7)cc5)oc5ccccc56)cc4)nc(-c4ccccc4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cc5oc6ccccc6c5cc4-c4cccc(-c5nc(-c6ccc7ccccc7c6)nc(-c6cccc7ccccc67)n5)c4)cc3)n2)cc1
InChIInChI=1S/C62H38N6O.C62H40N4O.C49H31N5O.C43H27N5O/c1-3-17-42(18-4-1)57-63-58(43-19-5-2-6-20-43)65-59(64-57)44-32-30-41(31-33-44)53-38-56-54(50-26-11-12-28-55(50)69-56)37-52(53)46-23-13-24-47(36-46)60-66-61(48-34-29-39-15-7-8-21-45(39)35-48)68-62(67-60)51-27-14-22-40-16-9-10-25-49(40)51;1-5-16-41(17-6-1)49-24-15-25-50(36-49)58-40-57(65-62(66-58)48-22-11-4-12-23-48)46-32-28-42(29-33-46)52-37-54-51-26-13-14-27-59(51)67-60(54)38-53(52)43-30-34-45(35-31-43)56-39-55(44-18-7-2-8-19-44)63-61(64-56)47-20-9-3-10-21-47;1-5-16-32(17-6-1)42-31-43(33-18-7-2-8-19-33)51-48(50-42)37-25-15-24-36(28-37)39-29-40-38-26-13-14-27-44(38)55-45(40)30-41(39)49-53-46(34-20-9-3-10-21-34)52-47(54-49)35-22-11-4-12-23-35;1-4-12-29(13-5-1)37-24-25-38(48-47-37)30-22-20-28(21-23-30)34-27-40-35(33-18-10-11-19-39(33)49-40)26-36(34)43-45-41(31-14-6-2-7-15-31)44-42(46-43)32-16-8-3-9-17-32/h1-38H;1-40H;1-31H;1-27H
InChIKeyNNMCKGWKPBYLCK-UHFFFAOYSA-N
MW3075.60 g/mol
LogP54.56
Rot. Bonds30

About 2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine

2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine (PubChem CID 159831160) has the molecular formula C216H136N20O4 and a molecular weight of 3075.60 g/mol. Its IUPAC name is 2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine.

Molecular Properties

Compound Name2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine
PubChem CID159831160
Molecular FormulaC216H136N20O4
Molecular Weight3075.60 g/mol
Exact Mass3073.11
IUPAC Name2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4cc5c(cc4-c4nc(-c6ccccc6)nc(-c6ccccc6)n4)oc4ccccc45)c3)n2)cc1.c1ccc(-c2ccc(-c3ccc(-c4cc5oc6ccccc6c5cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)nn2)cc1.c1ccc(-c2cccc(-c3cc(-c4ccc(-c5cc6c(cc5-c5ccc(-c7cc(-c8ccccc8)nc(-c8ccccc8)n7)cc5)oc5ccccc56)cc4)nc(-c4ccccc4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cc5oc6ccccc6c5cc4-c4cccc(-c5nc(-c6ccc7ccccc7c6)nc(-c6cccc7ccccc67)n5)c4)cc3)n2)cc1
InChIInChI=1S/C62H38N6O.C62H40N4O.C49H31N5O.C43H27N5O/c1-3-17-42(18-4-1)57-63-58(43-19-5-2-6-20-43)65-59(64-57)44-32-30-41(31-33-44)53-38-56-54(50-26-11-12-28-55(50)69-56)37-52(53)46-23-13-24-47(36-46)60-66-61(48-34-29-39-15-7-8-21-45(39)35-48)68-62(67-60)51-27-14-22-40-16-9-10-25-49(40)51;1-5-16-41(17-6-1)49-24-15-25-50(36-49)58-40-57(65-62(66-58)48-22-11-4-12-23-48)46-32-28-42(29-33-46)52-37-54-51-26-13-14-27-59(51)67-60(54)38-53(52)43-30-34-45(35-31-43)56-39-55(44-18-7-2-8-19-44)63-61(64-56)47-20-9-3-10-21-47;1-5-16-32(17-6-1)42-31-43(33-18-7-2-8-19-33)51-48(50-42)37-25-15-24-36(28-37)39-29-40-38-26-13-14-27-44(38)55-45(40)30-41(39)49-53-46(34-20-9-3-10-21-34)52-47(54-49)35-22-11-4-12-23-35;1-4-12-29(13-5-1)37-24-25-38(48-47-37)30-22-20-28(21-23-30)34-27-40-35(33-18-10-11-19-39(33)49-40)26-36(34)43-45-41(31-14-6-2-7-15-31)44-42(46-43)32-16-8-3-9-17-32/h1-38H;1-40H;1-31H;1-27H
InChIKeyNNMCKGWKPBYLCK-UHFFFAOYSA-N
XLogP54.56
TPSA310.36 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds30
Heavy Atoms240
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003075.60
LogP ≤ 554.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze 2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine?
The IUPAC name of 2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine (CID 159831160) is 2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine.
What is the SMILES notation for 2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine?
The canonical SMILES for 2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine is c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4cc5c(cc4-c4nc(-c6ccccc6)nc(-c6ccccc6)n4)oc4ccccc45)c3)n2)cc1.c1ccc(-c2ccc(-c3ccc(-c4cc5oc6ccccc6c5cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)nn2)cc1.c1ccc(-c2cccc(-c3cc(-c4ccc(-c5cc6c(cc5-c5ccc(-c7cc(-c8ccccc8)nc(-c8ccccc8)n7)cc5)oc5ccccc56)cc4)nc(-c4ccccc4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cc5oc6ccccc6c5cc4-c4cccc(-c5nc(-c6ccc7ccccc7c6)nc(-c6cccc7ccccc67)n5)c4)cc3)n2)cc1.
What is the InChIKey of 2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine?
The InChIKey is NNMCKGWKPBYLCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H38N6O.C62H40N4O.C49H31N5O.C43H27N5O/c1-3-17-42(18-4-1)57-63-58(43-19-5-2-6-20-43)65-59(64-57)44-32-30-41(31-33-44)53-38-56-54(50-26-11-12-28-55(50)69-56)37-52(53)46-23-13-24-47(36-46)60-66-61(48-34-29-39-15-7-8-21-45(39)35-48)68-62(67-60)51-27-14-22-40-16-9-10-25-49(40)51;1-5-16-41(17-6-1)49-24-15-25-50(36-49)58-40-57(65-62(66-58)48-22-11-4-12-23-48)46-32-28-42(29-33-46)52-37-54-51-26-13-14-27-59(51)67-60(54)38-53(52)43-30-34-45(35-31-43)56-39-55(44-18-7-2-8-19-44)63-61(64-56)47-20-9-3-10-21-47;1-5-16-32(17-6-1)42-31-43(33-18-7-2-8-19-33)51-48(50-42)37-25-15-24-36(28-37)39-29-40-38-26-13-14-27-44(38)55-45(40)30-41(39)49-53-46(34-20-9-3-10-21-34)52-47(54-49)35-22-11-4-12-23-35;1-4-12-29(13-5-1)37-24-25-38(48-47-37)30-22-20-28(21-23-30)34-27-40-35(33-18-10-11-19-39(33)49-40)26-36(34)43-45-41(31-14-6-2-7-15-31)44-42(46-43)32-16-8-3-9-17-32/h1-38H;1-40H;1-31H;1-27H.
What are the key properties of 2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine?
2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine has a molecular weight of 3075.60 g/mol, XLogP of 54.56, 30 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenyl-6-[4-[2-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]dibenzofuran-3-yl]phenyl]pyrimidine;2,4-diphenyl-6-[3-[4-(6-phenylpyridazin-3-yl)phenyl]dibenzofuran-2-yl]-1,3,5-triazine;2-[2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]phenyl]-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine is sourced from PubChem (CID 159831160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).