2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine

C88H54N8O2 — CID 137465849

IUPAC2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine
SMILESc1ccc(-c2cc(-c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)nc(-c3ccc(-c4cn5cc(-c6cccc7c6oc6ccc(-c8ccc(-c9cc(-c%10ccccc%10)nc(-c%10ccc(-c%11nc%12ccccc%12n%11-c%11ccccc%11)cc%10)n9)cc8)cc67)ccc5n4)cc3)n2)cc1
InChIInChI=1S/C88H54N8O2/c1-4-15-57(16-5-1)75-51-77(59-31-27-55(28-32-59)65-43-46-82-72(49-65)70-21-10-13-26-81(70)97-82)92-86(90-75)62-37-35-61(36-38-62)79-54-95-53-67(45-48-84(95)89-79)69-22-14-23-71-73-50-66(44-47-83(73)98-85(69)71)56-29-33-60(34-30-56)78-52-76(58-17-6-2-7-18-58)91-87(93-78)63-39-41-64(42-40-63)88-94-74-24-11-12-25-80(74)96(88)68-19-8-3-9-20-68/h1-54H
InChIKeyFQMXEOQWNRPWBX-UHFFFAOYSA-N
MW1255.45 g/mol
LogP22.39
Rot. Bonds12

About 2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine

2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine (PubChem CID 137465849) has the molecular formula C88H54N8O2 and a molecular weight of 1255.45 g/mol. Its IUPAC name is 2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine
PubChem CID137465849
Molecular FormulaC88H54N8O2
Molecular Weight1255.45 g/mol
Exact Mass1254.44
IUPAC Name2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine
SMILESc1ccc(-c2cc(-c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)nc(-c3ccc(-c4cn5cc(-c6cccc7c6oc6ccc(-c8ccc(-c9cc(-c%10ccccc%10)nc(-c%10ccc(-c%11nc%12ccccc%12n%11-c%11ccccc%11)cc%10)n9)cc8)cc67)ccc5n4)cc3)n2)cc1
InChIInChI=1S/C88H54N8O2/c1-4-15-57(16-5-1)75-51-77(59-31-27-55(28-32-59)65-43-46-82-72(49-65)70-21-10-13-26-81(70)97-82)92-86(90-75)62-37-35-61(36-38-62)79-54-95-53-67(45-48-84(95)89-79)69-22-14-23-71-73-50-66(44-47-83(73)98-85(69)71)56-29-33-60(34-30-56)78-52-76(58-17-6-2-7-18-58)91-87(93-78)63-39-41-64(42-40-63)88-94-74-24-11-12-25-80(74)96(88)68-19-8-3-9-20-68/h1-54H
InChIKeyFQMXEOQWNRPWBX-UHFFFAOYSA-N
XLogP22.39
TPSA112.96 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds12
Heavy Atoms98
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001255.45
LogP ≤ 522.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine with MolForge

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Related Compounds

3-dibenzofuran-2-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;4-(4-dibenzofuran-4-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine;9-[4-[6-(4-dibenzofuran-2-ylphenyl)-2-phenylpyrimidin-4-yl]phenyl]carbazole;3-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 159354385
9-(4-dibenzofuran-4-ylphenyl)-2-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole
CID 118149434
3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
CID 158764250
4-[3,5-di(dibenzofuran-2-yl)phenyl]-6-phenyl-2-(4-phenylphenyl)pyrimidine;4-[3,5-di(dibenzofuran-4-yl)phenyl]-6-phenyl-2-(4-phenylphenyl)pyrimidine
CID 161324987
4,6-bis(4-dibenzofuran-3-ylphenyl)-2-phenylpyrimidine;4,6-bis(4-dibenzofuran-4-ylphenyl)-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-6-(4-dibenzofuran-4-ylphenyl)-2-phenylpyrimidine;2,4,6-tris(4-dibenzofuran-4-ylphenyl)pyrimidine
CID 162075982
4-(3-dibenzofuran-2-yl-5-dibenzofuran-4-ylphenyl)-2-phenyl-6-[4-(3-phenylphenyl)phenyl]pyrimidine
CID 160752497
4-(3-dibenzofuran-2-ylphenyl)-6-[3,5-di(dibenzofuran-2-yl)phenyl]-2-phenylpyrimidine;4-(3-dibenzofuran-2-ylphenyl)-6-[3,5-di(dibenzofuran-4-yl)phenyl]-2-phenylpyrimidine;4-(3-dibenzofuran-4-ylphenyl)-6-[3,5-di(dibenzofuran-2-yl)phenyl]-2-phenylpyrimidine;4-(3-dibenzofuran-4-ylphenyl)-6-[3,5-di(dibenzofuran-4-yl)phenyl]-2-phenylpyrimidine;4-[3,5-di(dibenzofuran-2-yl)phenyl]-2-phenyl-6-[4-(3-phenylphenyl)phenyl]pyrimidine;4-[3,5-di(dibenzofuran-4-yl)phenyl]-2-phenyl-6-[4-(3-phenylphenyl)phenyl]pyrimidine
CID 158944867
2-[4-[3-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]-1-phenylbenzimidazole;2-[4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-1-phenylbenzimidazole;1-phenyl-2-[4-[3-[4-phenyl-6-[3-(4-phenylphenyl)phenyl]pyrimidin-2-yl]phenyl]phenyl]benzimidazole;1-phenyl-2-[4-[3-[4-phenyl-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]benzimidazole
CID 161378320
3-(5-dibenzofuran-2-ylnaphthalen-1-yl)-9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole;3-(5-dibenzofuran-4-ylnaphthalen-1-yl)-9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole;3-(5-dibenzofuran-2-ylnaphthalen-1-yl)-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole
CID 159689631
3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-9-phenyl-6-(1-phenylbenzimidazol-2-yl)carbazole
CID 129292117
N,N-bis(4-dibenzofuran-4-ylphenyl)-4-(4-phenylphenyl)aniline;2-(4-dibenzofuran-2-ylphenyl)-4,6-diphenyl-1,3,5-triazine;3-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-2-yl]-9-phenylcarbazole
CID 161033096
9-(4-dibenzofuran-2-ylphenyl)-3-[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazole
CID 118149535

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine?
The IUPAC name of 2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine (CID 137465849) is 2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine?
The canonical SMILES for 2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine is c1ccc(-c2cc(-c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)nc(-c3ccc(-c4cn5cc(-c6cccc7c6oc6ccc(-c8ccc(-c9cc(-c%10ccccc%10)nc(-c%10ccc(-c%11nc%12ccccc%12n%11-c%11ccccc%11)cc%10)n9)cc8)cc67)ccc5n4)cc3)n2)cc1.
What is the InChIKey of 2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine?
The InChIKey is FQMXEOQWNRPWBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C88H54N8O2/c1-4-15-57(16-5-1)75-51-77(59-31-27-55(28-32-59)65-43-46-82-72(49-65)70-21-10-13-26-81(70)97-82)92-86(90-75)62-37-35-61(36-38-62)79-54-95-53-67(45-48-84(95)89-79)69-22-14-23-71-73-50-66(44-47-83(73)98-85(69)71)56-29-33-60(34-30-56)78-52-76(58-17-6-2-7-18-58)91-87(93-78)63-39-41-64(42-40-63)88-94-74-24-11-12-25-80(74)96(88)68-19-8-3-9-20-68/h1-54H.
What are the key properties of 2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine?
2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine has a molecular weight of 1255.45 g/mol, XLogP of 22.39, 12 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-(4-dibenzofuran-2-ylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-6-[8-[4-[6-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]pyrimidin-4-yl]phenyl]dibenzofuran-4-yl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 137465849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).