2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine

C248H156N12O7 — CID 158936996

IUPAC2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)cc(-c4ccccn4)n3)c2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5cc6ccccc6c6oc7ccccc7c56)cc4)nc(-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc6oc7ccc8ccccc8c7c6c5)cc4)nc(-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)n3)cc2)cc1.c1ccc(-c2nc(-c3ccc(-c4cccc(-c5cc(-c6ccc7oc8ccccc8c7c6)cc(-c6ccc7oc8ccccc8c7c6)c5)c4)cc3)cc(-c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)n2)cc1
InChIInChI=1S/C70H42N2O3.2C45H29N3O.2C44H28N2O/c1-2-11-47(12-3-1)70-71-62(42-63(72-70)46-27-23-44(24-28-46)50-29-32-67-59(39-50)56-15-4-7-18-64(56)73-67)45-25-21-43(22-26-45)48-13-10-14-49(35-48)53-36-54(51-30-33-68-60(40-51)57-16-5-8-19-65(57)74-68)38-55(37-53)52-31-34-69-61(41-52)58-17-6-9-20-66(58)75-69;1-3-11-30(12-4-1)35-25-36(31-13-5-2-6-14-31)27-37(26-35)45-47-41(29-42(48-45)40-16-9-10-24-46-40)33-20-18-32(19-21-33)34-22-23-44-39(28-34)38-15-7-8-17-43(38)49-44;1-3-9-30(10-4-1)32-15-21-35(22-16-32)43-46-44(36-23-17-33(18-24-36)31-11-5-2-6-12-31)48-45(47-43)37-25-19-34(20-26-37)38-27-28-42-40(29-38)39-13-7-8-14-41(39)49-42;1-3-11-29(12-4-1)30-19-23-32(24-20-30)39-28-40(46-44(45-39)34-13-5-2-6-14-34)33-25-21-31(22-26-33)38-27-35-15-7-8-16-36(35)43-42(38)37-17-9-10-18-41(37)47-43;1-3-9-29(10-4-1)30-15-19-33(20-16-30)39-28-40(46-44(45-39)35-12-5-2-6-13-35)34-21-17-31(18-22-34)36-24-25-41-38(27-36)43-37-14-8-7-11-32(37)23-26-42(43)47-41/h1-42H;2*1-29H;2*1-28H
InChIKeyJJTUBPCHKRCZKK-UHFFFAOYSA-N
MW3416.05 g/mol
LogP66.79
Rot. Bonds30

About 2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine

2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine (PubChem CID 158936996) has the molecular formula C248H156N12O7 and a molecular weight of 3416.05 g/mol. Its IUPAC name is 2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine.

Molecular Properties

Compound Name2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine
PubChem CID158936996
Molecular FormulaC248H156N12O7
Molecular Weight3416.05 g/mol
Exact Mass3413.22
IUPAC Name2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)cc(-c4ccccn4)n3)c2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5cc6ccccc6c6oc7ccccc7c56)cc4)nc(-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc6oc7ccc8ccccc8c7c6c5)cc4)nc(-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)n3)cc2)cc1.c1ccc(-c2nc(-c3ccc(-c4cccc(-c5cc(-c6ccc7oc8ccccc8c7c6)cc(-c6ccc7oc8ccccc8c7c6)c5)c4)cc3)cc(-c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)n2)cc1
InChIInChI=1S/C70H42N2O3.2C45H29N3O.2C44H28N2O/c1-2-11-47(12-3-1)70-71-62(42-63(72-70)46-27-23-44(24-28-46)50-29-32-67-59(39-50)56-15-4-7-18-64(56)73-67)45-25-21-43(22-26-45)48-13-10-14-49(35-48)53-36-54(51-30-33-68-60(40-51)57-16-5-8-19-65(57)74-68)38-55(37-53)52-31-34-69-61(41-52)58-17-6-9-20-66(58)75-69;1-3-11-30(12-4-1)35-25-36(31-13-5-2-6-14-31)27-37(26-35)45-47-41(29-42(48-45)40-16-9-10-24-46-40)33-20-18-32(19-21-33)34-22-23-44-39(28-34)38-15-7-8-17-43(38)49-44;1-3-9-30(10-4-1)32-15-21-35(22-16-32)43-46-44(36-23-17-33(18-24-36)31-11-5-2-6-12-31)48-45(47-43)37-25-19-34(20-26-37)38-27-28-42-40(29-38)39-13-7-8-14-41(39)49-42;1-3-11-29(12-4-1)30-19-23-32(24-20-30)39-28-40(46-44(45-39)34-13-5-2-6-14-34)33-25-21-31(22-26-33)38-27-35-15-7-8-16-36(35)43-42(38)37-17-9-10-18-41(37)47-43;1-3-9-29(10-4-1)30-15-19-33(20-16-30)39-28-40(46-44(45-39)35-12-5-2-6-13-35)34-21-17-31(18-22-34)36-24-25-41-38(27-36)43-37-14-8-7-11-32(37)23-26-42(43)47-41/h1-42H;2*1-29H;2*1-28H
InChIKeyJJTUBPCHKRCZKK-UHFFFAOYSA-N
XLogP66.79
TPSA246.66 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds30
Heavy Atoms267
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003416.05
LogP ≤ 566.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze 2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine?
The IUPAC name of 2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine (CID 158936996) is 2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine.
What is the SMILES notation for 2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine?
The canonical SMILES for 2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine is c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)cc(-c4ccccn4)n3)c2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5cc6ccccc6c6oc7ccccc7c56)cc4)nc(-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc6oc7ccc8ccccc8c7c6c5)cc4)nc(-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)n3)cc2)cc1.c1ccc(-c2nc(-c3ccc(-c4cccc(-c5cc(-c6ccc7oc8ccccc8c7c6)cc(-c6ccc7oc8ccccc8c7c6)c5)c4)cc3)cc(-c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)n2)cc1.
What is the InChIKey of 2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine?
The InChIKey is JJTUBPCHKRCZKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H42N2O3.2C45H29N3O.2C44H28N2O/c1-2-11-47(12-3-1)70-71-62(42-63(72-70)46-27-23-44(24-28-46)50-29-32-67-59(39-50)56-15-4-7-18-64(56)73-67)45-25-21-43(22-26-45)48-13-10-14-49(35-48)53-36-54(51-30-33-68-60(40-51)57-16-5-8-19-65(57)74-68)38-55(37-53)52-31-34-69-61(41-52)58-17-6-9-20-66(58)75-69;1-3-11-30(12-4-1)35-25-36(31-13-5-2-6-14-31)27-37(26-35)45-47-41(29-42(48-45)40-16-9-10-24-46-40)33-20-18-32(19-21-33)34-22-23-44-39(28-34)38-15-7-8-17-43(38)49-44;1-3-9-30(10-4-1)32-15-21-35(22-16-32)43-46-44(36-23-17-33(18-24-36)31-11-5-2-6-12-31)48-45(47-43)37-25-19-34(20-26-37)38-27-28-42-40(29-38)39-13-7-8-14-41(39)49-42;1-3-11-29(12-4-1)30-19-23-32(24-20-30)39-28-40(46-44(45-39)34-13-5-2-6-14-34)33-25-21-31(22-26-33)38-27-35-15-7-8-16-36(35)43-42(38)37-17-9-10-18-41(37)47-43;1-3-9-29(10-4-1)30-15-19-33(20-16-30)39-28-40(46-44(45-39)35-12-5-2-6-13-35)34-21-17-31(18-22-34)36-24-25-41-38(27-36)43-37-14-8-7-11-32(37)23-26-42(43)47-41/h1-42H;2*1-29H;2*1-28H.
What are the key properties of 2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine?
2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine has a molecular weight of 3416.05 g/mol, XLogP of 66.79, 30 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-dibenzofuran-2-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;4-(4-dibenzofuran-2-ylphenyl)-6-[4-[3-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2-(3,5-diphenylphenyl)-6-pyridin-2-ylpyrimidine;4-(4-naphtho[1,2-b][1]benzofuran-6-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;4-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine is sourced from PubChem (CID 158936996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).