4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine

C138H92N4O4 — CID 159282220

IUPAC4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine
SMILESCC1(C)c2cc(-c3ccc4oc5c(-c6ccccc6)cccc5c4c3)ccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc21.CC1(C)c2ccc(-c3cccc4ccccc34)cc2-c2ccc(-c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc21.c1ccc(-c2cc(-c3cc(-c4cccc5c4oc4ccccc45)cc(-c4cccc5c4oc4ccccc45)c3)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/C48H33N3O.C47H29NO2.C43H30O/c1-48(2)41-28-34(33-23-26-43-40(27-33)39-20-12-19-36(44(39)52-43)30-13-6-3-7-14-30)21-24-37(41)38-25-22-35(29-42(38)48)47-50-45(31-15-8-4-9-16-31)49-46(51-47)32-17-10-5-11-18-32;1-3-13-30(14-4-1)42-28-33(29-43(48-42)31-15-5-2-6-16-31)32-25-34(36-19-11-21-40-38-17-7-9-23-44(38)49-46(36)40)27-35(26-32)37-20-12-22-41-39-18-8-10-24-45(39)50-47(37)41;1-43(2)39-24-22-31(33-13-7-10-28-9-3-4-11-32(28)33)25-38(39)35-23-21-30(26-40(35)43)27-17-19-29(20-18-27)34-14-8-15-37-36-12-5-6-16-41(36)44-42(34)37/h3-29H,1-2H3;1-29H;3-26H,1-2H3
InChIKeyKZBHDNCRFIQOLR-UHFFFAOYSA-N
MW1870.28 g/mol
LogP37.67
Rot. Bonds13

About 4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine

4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine (PubChem CID 159282220) has the molecular formula C138H92N4O4 and a molecular weight of 1870.28 g/mol. Its IUPAC name is 4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine.

Molecular Properties

Compound Name4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine
PubChem CID159282220
Molecular FormulaC138H92N4O4
Molecular Weight1870.28 g/mol
Exact Mass1868.71
IUPAC Name4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine
SMILESCC1(C)c2cc(-c3ccc4oc5c(-c6ccccc6)cccc5c4c3)ccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc21.CC1(C)c2ccc(-c3cccc4ccccc34)cc2-c2ccc(-c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc21.c1ccc(-c2cc(-c3cc(-c4cccc5c4oc4ccccc45)cc(-c4cccc5c4oc4ccccc45)c3)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/C48H33N3O.C47H29NO2.C43H30O/c1-48(2)41-28-34(33-23-26-43-40(27-33)39-20-12-19-36(44(39)52-43)30-13-6-3-7-14-30)21-24-37(41)38-25-22-35(29-42(38)48)47-50-45(31-15-8-4-9-16-31)49-46(51-47)32-17-10-5-11-18-32;1-3-13-30(14-4-1)42-28-33(29-43(48-42)31-15-5-2-6-16-31)32-25-34(36-19-11-21-40-38-17-7-9-23-44(38)49-46(36)40)27-35(26-32)37-20-12-22-41-39-18-8-10-24-45(39)50-47(37)41;1-43(2)39-24-22-31(33-13-7-10-28-9-3-4-11-32(28)33)25-38(39)35-23-21-30(26-40(35)43)27-17-19-29(20-18-27)34-14-8-15-37-36-12-5-6-16-41(36)44-42(34)37/h3-29H,1-2H3;1-29H;3-26H,1-2H3
InChIKeyKZBHDNCRFIQOLR-UHFFFAOYSA-N
XLogP37.67
TPSA104.12 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds13
Heavy Atoms146
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001870.28
LogP ≤ 537.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine with MolForge

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Related Compounds

4-[3,5-di(dibenzofuran-2-yl)phenyl]-6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidine;4-[3,5-di(dibenzofuran-4-yl)phenyl]-6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidine;4-[3,5-di(dibenzofuran-2-yl)phenyl]-2-phenyl-6-(3-phenylphenyl)pyrimidine;4-[3,5-di(dibenzofuran-4-yl)phenyl]-2-phenyl-6-(3-phenylphenyl)pyrimidine
CID 160795004
4,6-bis[3,5-di(dibenzofuran-2-yl)phenyl]-2-phenylpyrimidine;4,6-bis[3,5-di(dibenzofuran-4-yl)phenyl]-2-phenylpyrimidine;4-(4-dibenzofuran-4-ylphenyl)-6-[3,5-di(dibenzofuran-4-yl)phenyl]-2-phenylpyrimidine;2-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-4-(4-naphthalen-1-ylphenyl)-6-phenylpyrimidine
CID 159701721
4-[3-dibenzofuran-2-yl-5-(3-naphthalen-1-ylphenyl)phenyl]-6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidine
CID 171583328
4-[3,5-di(dibenzofuran-4-yl)phenyl]-6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidine;4-[3,5-di(dibenzofuran-2-yl)phenyl]-6-(4-fluorophenyl)-2-phenylpyrimidine;4-[3,5-di(dibenzofuran-4-yl)phenyl]-6-(4-fluorophenyl)-2-phenylpyrimidine;4-[3,5-di(dibenzofuran-2-yl)phenyl]-2-phenyl-6-(3-phenylphenyl)pyrimidine;4-[3,5-di(dibenzofuran-4-yl)phenyl]-2-phenyl-6-(3-phenylphenyl)pyrimidine
CID 159545616
4-(3-dibenzofuran-4-yl-5-naphthalen-1-ylphenyl)-6-[2-(9,9-dimethylfluoren-3-yl)phenyl]-2-phenylpyrimidine
CID 171584972
4-(3-dibenzofuran-4-yl-5-phenylphenyl)-6-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylpyrimidine
CID 171585086
4-[3-dibenzofuran-2-yl-5-[3-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-2,6-diphenylpyrimidine
CID 171582716
4-[3-dibenzofuran-2-yl-5-(2-phenylphenyl)phenyl]-6-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-phenylpyrimidine
CID 171584389
4-[3-dibenzofuran-2-yl-5-(3-phenylphenyl)phenyl]-6-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-phenylpyrimidine
CID 171583701
2-[3-[8-(9,9-dimethylfluoren-2-yl)-2-phenyldibenzofuran-4-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 121244814
4-[3,5-di(dibenzofuran-2-yl)phenyl]-6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidine;4-[3,5-di(dibenzofuran-1-yl)phenyl]-6-naphthalen-1-yl-2-phenylpyrimidine;4-[3,5-di(dibenzofuran-2-yl)phenyl]-6-naphthalen-1-yl-2-phenylpyrimidine;4-[3,5-di(dibenzofuran-3-yl)phenyl]-6-naphthalen-1-yl-2-phenylpyrimidine;4-[3,5-di(dibenzofuran-4-yl)phenyl]-6-naphthalen-1-yl-2-phenylpyrimidine
CID 159119029
2-dibenzofuran-4-yl-4-[3-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine
CID 166025643

Frequently Asked Questions

What is the IUPAC name of 4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine?
The IUPAC name of 4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine (CID 159282220) is 4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine.
What is the SMILES notation for 4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine?
The canonical SMILES for 4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine is CC1(C)c2cc(-c3ccc4oc5c(-c6ccccc6)cccc5c4c3)ccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc21.CC1(C)c2ccc(-c3cccc4ccccc34)cc2-c2ccc(-c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc21.c1ccc(-c2cc(-c3cc(-c4cccc5c4oc4ccccc45)cc(-c4cccc5c4oc4ccccc45)c3)cc(-c3ccccc3)n2)cc1.
What is the InChIKey of 4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine?
The InChIKey is KZBHDNCRFIQOLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H33N3O.C47H29NO2.C43H30O/c1-48(2)41-28-34(33-23-26-43-40(27-33)39-20-12-19-36(44(39)52-43)30-13-6-3-7-14-30)21-24-37(41)38-25-22-35(29-42(38)48)47-50-45(31-15-8-4-9-16-31)49-46(51-47)32-17-10-5-11-18-32;1-3-13-30(14-4-1)42-28-33(29-43(48-42)31-15-5-2-6-16-31)32-25-34(36-19-11-21-40-38-17-7-9-23-44(38)49-46(36)40)27-35(26-32)37-20-12-22-41-39-18-8-10-24-45(39)50-47(37)41;1-43(2)39-24-22-31(33-13-7-10-28-9-3-4-11-32(28)33)25-38(39)35-23-21-30(26-40(35)43)27-17-19-29(20-18-27)34-14-8-15-37-36-12-5-6-16-41(36)44-42(34)37/h3-29H,1-2H3;1-29H;3-26H,1-2H3.
What are the key properties of 4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine?
4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine has a molecular weight of 1870.28 g/mol, XLogP of 37.67, 13 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3,5-di(dibenzofuran-4-yl)phenyl]-2,6-diphenylpyridine;4-[4-(9,9-dimethyl-6-naphthalen-1-ylfluoren-2-yl)phenyl]dibenzofuran;2-[9,9-dimethyl-7-(6-phenyldibenzofuran-2-yl)fluoren-2-yl]-4,6-diphenyl-1,3,5-triazine is sourced from PubChem (CID 159282220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).