2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole

C182H136N8O4 — CID 158065967

IUPAC2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole
SMILESCC(C)(C)c1ccc2oc3c(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc(C(C)(C)C)cc3c2c1.CC(C)c1ccc2oc3c(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc(C(C)C)cc3c2c1.c1ccc(-c2ccc(-c3ccc4oc5c(-c6cccc(-c7nc8ccccc8n7-c7ccccc7)c6)cc(-c6ccc(-c7ccccc7)cc6)cc5c4c3)cc2)cc1.c1ccc(-n2c(-c3cccc(-c4cc(-c5cccc6ccccc56)cc5c4oc4ccc(-c6cccc7ccccc67)cc45)c3)nc3ccccc32)cc1
InChIInChI=1S/C55H36N2O.C51H32N2O.C39H36N2O.C37H32N2O/c1-4-13-37(14-5-1)39-23-27-41(28-24-39)43-31-32-53-49(34-43)50-36-46(42-29-25-40(26-30-42)38-15-6-2-7-16-38)35-48(54(50)58-53)44-17-12-18-45(33-44)55-56-51-21-10-11-22-52(51)57(55)47-19-8-3-9-20-47;1-2-19-39(20-3-1)53-48-26-9-8-25-47(48)52-51(53)37-18-10-17-35(29-37)44-31-38(43-24-12-16-34-14-5-7-22-41(34)43)32-46-45-30-36(27-28-49(45)54-50(44)46)42-23-11-15-33-13-4-6-21-40(33)42;1-38(2,3)27-19-20-35-31(22-27)32-24-28(39(4,5)6)23-30(36(32)42-35)25-13-12-14-26(21-25)37-40-33-17-10-11-18-34(33)41(37)29-15-8-7-9-16-29;1-23(2)25-17-18-35-31(20-25)32-22-28(24(3)4)21-30(36(32)40-35)26-11-10-12-27(19-26)37-38-33-15-8-9-16-34(33)39(37)29-13-6-5-7-14-29/h1-36H;1-32H;7-24H,1-6H3;5-24H,1-4H3
InChIKeyFLFNBRWAGPQDAN-UHFFFAOYSA-N
MW2499.14 g/mol
LogP50.19
Rot. Bonds20

About 2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole

2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole (PubChem CID 158065967) has the molecular formula C182H136N8O4 and a molecular weight of 2499.14 g/mol. Its IUPAC name is 2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole.

Molecular Properties

Compound Name2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole
PubChem CID158065967
Molecular FormulaC182H136N8O4
Molecular Weight2499.14 g/mol
Exact Mass2497.07
IUPAC Name2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole
SMILESCC(C)(C)c1ccc2oc3c(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc(C(C)(C)C)cc3c2c1.CC(C)c1ccc2oc3c(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc(C(C)C)cc3c2c1.c1ccc(-c2ccc(-c3ccc4oc5c(-c6cccc(-c7nc8ccccc8n7-c7ccccc7)c6)cc(-c6ccc(-c7ccccc7)cc6)cc5c4c3)cc2)cc1.c1ccc(-n2c(-c3cccc(-c4cc(-c5cccc6ccccc56)cc5c4oc4ccc(-c6cccc7ccccc67)cc45)c3)nc3ccccc32)cc1
InChIInChI=1S/C55H36N2O.C51H32N2O.C39H36N2O.C37H32N2O/c1-4-13-37(14-5-1)39-23-27-41(28-24-39)43-31-32-53-49(34-43)50-36-46(42-29-25-40(26-30-42)38-15-6-2-7-16-38)35-48(54(50)58-53)44-17-12-18-45(33-44)55-56-51-21-10-11-22-52(51)57(55)47-19-8-3-9-20-47;1-2-19-39(20-3-1)53-48-26-9-8-25-47(48)52-51(53)37-18-10-17-35(29-37)44-31-38(43-24-12-16-34-14-5-7-22-41(34)43)32-46-45-30-36(27-28-49(45)54-50(44)46)42-23-11-15-33-13-4-6-21-40(33)42;1-38(2,3)27-19-20-35-31(22-27)32-24-28(39(4,5)6)23-30(36(32)42-35)25-13-12-14-26(21-25)37-40-33-17-10-11-18-34(33)41(37)29-15-8-7-9-16-29;1-23(2)25-17-18-35-31(20-25)32-22-28(24(3)4)21-30(36(32)40-35)26-11-10-12-27(19-26)37-38-33-15-8-9-16-34(33)39(37)29-13-6-5-7-14-29/h1-36H;1-32H;7-24H,1-6H3;5-24H,1-4H3
InChIKeyFLFNBRWAGPQDAN-UHFFFAOYSA-N
XLogP50.19
TPSA123.84 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds20
Heavy Atoms194
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002499.14
LogP ≤ 550.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole?
The IUPAC name of 2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole (CID 158065967) is 2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole.
What is the SMILES notation for 2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole?
The canonical SMILES for 2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole is CC(C)(C)c1ccc2oc3c(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc(C(C)(C)C)cc3c2c1.CC(C)c1ccc2oc3c(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc(C(C)C)cc3c2c1.c1ccc(-c2ccc(-c3ccc4oc5c(-c6cccc(-c7nc8ccccc8n7-c7ccccc7)c6)cc(-c6ccc(-c7ccccc7)cc6)cc5c4c3)cc2)cc1.c1ccc(-n2c(-c3cccc(-c4cc(-c5cccc6ccccc56)cc5c4oc4ccc(-c6cccc7ccccc67)cc45)c3)nc3ccccc32)cc1.
What is the InChIKey of 2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole?
The InChIKey is FLFNBRWAGPQDAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H36N2O.C51H32N2O.C39H36N2O.C37H32N2O/c1-4-13-37(14-5-1)39-23-27-41(28-24-39)43-31-32-53-49(34-43)50-36-46(42-29-25-40(26-30-42)38-15-6-2-7-16-38)35-48(54(50)58-53)44-17-12-18-45(33-44)55-56-51-21-10-11-22-52(51)57(55)47-19-8-3-9-20-47;1-2-19-39(20-3-1)53-48-26-9-8-25-47(48)52-51(53)37-18-10-17-35(29-37)44-31-38(43-24-12-16-34-14-5-7-22-41(34)43)32-46-45-30-36(27-28-49(45)54-50(44)46)42-23-11-15-33-13-4-6-21-40(33)42;1-38(2,3)27-19-20-35-31(22-27)32-24-28(39(4,5)6)23-30(36(32)42-35)25-13-12-14-26(21-25)37-40-33-17-10-11-18-34(33)41(37)29-15-8-7-9-16-29;1-23(2)25-17-18-35-31(20-25)32-22-28(24(3)4)21-30(36(32)40-35)26-11-10-12-27(19-26)37-38-33-15-8-9-16-34(33)39(37)29-13-6-5-7-14-29/h1-36H;1-32H;7-24H,1-6H3;5-24H,1-4H3.
What are the key properties of 2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole?
2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole has a molecular weight of 2499.14 g/mol, XLogP of 50.19, 20 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[2,8-bis(4-phenylphenyl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole;2-[3-(2,8-ditert-butyldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-1-phenylbenzimidazole;2-[3-[2,8-di(propan-2-yl)dibenzofuran-4-yl]phenyl]-1-phenylbenzimidazole is sourced from PubChem (CID 158065967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).