7-[4,5-bis(2-ethylbenzimidazol-1-yl)anthracen-9-yl]-2-ethyl-1-phenylbenzimidazole;1-[4,5-bis(1-ethyl-2-phenylbenzimidazol-4-yl)anthracen-9-yl]-9-phenylcarbazole;1-[10-dibenzofuran-4-yl-8-(2-ethylbenzimidazol-1-yl)anthracen-1-yl]-2-ethylbenzimidazole;1-ethyl-4-[8-(1-ethyl-2-phenylbenzimidazol-4-yl)-10-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole

C210H157N21O — CID 157480715

About 7-[4,5-bis(2-ethylbenzimidazol-1-yl)anthracen-9-yl]-2-ethyl-1-phenylbenzimidazole;1-[4,5-bis(1-ethyl-2-phenylbenzimidazol-4-yl)anthracen-9-yl]-9-phenylcarbazole;1-[10-dibenzofuran-4-yl-8-(2-ethylbenzimidazol-1-yl)anthracen-1-yl]-2-ethylbenzimidazole;1-ethyl-4-[8-(1-ethyl-2-phenylbenzimidazol-4-yl)-10-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole

7-[4,5-bis(2-ethylbenzimidazol-1-yl)anthracen-9-yl]-2-ethyl-1-phenylbenzimidazole;1-[4,5-bis(1-ethyl-2-phenylbenzimidazol-4-yl)anthracen-9-yl]-9-phenylcarbazole;1-[10-dibenzofuran-4-yl-8-(2-ethylbenzimidazol-1-yl)anthracen-1-yl]-2-ethylbenzimidazole;1-ethyl-4-[8-(1-ethyl-2-phenylbenzimidazol-4-yl)-10-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole (PubChem CID 157480715) has the molecular formula C210H157N21O and a molecular weight of 2990.71 g/mol. Its IUPAC name is 7-[4,5-bis(2-ethylbenzimidazol-1-yl)anthracen-9-yl]-2-ethyl-1-phenylbenzimidazole;1-[4,5-bis(1-ethyl-2-phenylbenzimidazol-4-yl)anthracen-9-yl]-9-phenylcarbazole;1-[10-dibenzofuran-4-yl-8-(2-ethylbenzimidazol-1-yl)anthracen-1-yl]-2-ethylbenzimidazole;1-ethyl-4-[8-(1-ethyl-2-phenylbenzimidazol-4-yl)-10-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole.

Molecular Properties

• Compound Name: 7-[4,5-bis(2-ethylbenzimidazol-1-yl)anthracen-9-yl]-2-ethyl-1-phenylbenzimidazole;1-[4,5-bis(1-ethyl-2-phenylbenzimidazol-4-yl)anthracen-9-yl]-9-phenylcarbazole;1-[10-dibenzofuran-4-yl-8-(2-ethylbenzimidazol-1-yl)anthracen-1-yl]-2-ethylbenzimidazole;1-ethyl-4-[8-(1-ethyl-2-phenylbenzimidazol-4-yl)-10-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole
• PubChem CID: 157480715
• Molecular Formula: C210H157N21O
• Molecular Weight: 2990.71 g/mol
• Exact Mass: 2988.29
• IUPAC Name: 7-[4,5-bis(2-ethylbenzimidazol-1-yl)anthracen-9-yl]-2-ethyl-1-phenylbenzimidazole;1-[4,5-bis(1-ethyl-2-phenylbenzimidazol-4-yl)anthracen-9-yl]-9-phenylcarbazole;1-[10-dibenzofuran-4-yl-8-(2-ethylbenzimidazol-1-yl)anthracen-1-yl]-2-ethylbenzimidazole;1-ethyl-4-[8-(1-ethyl-2-phenylbenzimidazol-4-yl)-10-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole
• SMILES: CCc1nc2ccccc2n1-c1cccc2c(-c3cccc4c3oc3ccccc34)c3cccc(-n4c(CC)nc5ccccc54)c3cc12.CCc1nc2ccccc2n1-c1cccc2c(-c3cccc4nc(CC)n(-c5ccccc5)c34)c3cccc(-n4c(CC)nc5ccccc54)c3cc12.CCn1c(-c2ccccc2)nc2c(-c3cccc4c(-c5cccc6c7ccccc7n(-c7ccccc7)c56)c5cccc(-c6cccc7c6nc(-c6ccccc6)n7CC)c5cc34)cccc21.CCn1c(-c2ccccc2)nc2c(-c3cccc4c(-n5c(-c6ccccc6)nc6ccccc65)c5cccc(-c6cccc7c6nc(-c6ccccc6)n7CC)c5cc34)cccc21
• InChI: InChI=1S/C62H45N5.C57H42N6.C47H38N6.C44H32N4O/c1-3-65-55-37-19-32-48(58(55)63-61(65)40-21-8-5-9-22-40)43-28-16-30-46-52(43)39-53-44(49-33-20-38-56-59(49)64-62(66(56)4-2)41-23-10-6-11-24-41)29-17-31-47(53)57(46)51-35-18-34-50-45-27-14-15-36-54(45)67(60(50)51)42-25-12-7-13-26-42;1-3-61-50-34-18-28-42(52(50)59-55(61)37-20-8-5-9-21-37)40-26-16-30-44-46(40)36-47-41(43-29-19-35-51-53(43)60-56(62(51)4-2)38-22-10-6-11-23-38)27-17-31-45(47)54(44)63-49-33-15-14-32-48(49)58-57(63)39-24-12-7-13-25-39;1-4-43-50-38-24-14-21-33(47(38)51(43)30-17-8-7-9-18-30)46-31-19-15-27-39(52-41-25-12-10-22-36(41)48-44(52)5-2)34(31)29-35-32(46)20-16-28-40(35)53-42-26-13-11-23-37(42)49-45(53)6-3;1-3-41-45-34-19-6-8-21-38(34)47(41)36-23-12-15-28-32(36)26-33-29(16-13-24-37(33)48-39-22-9-7-20-35(39)46-42(48)4-2)43(28)31-18-11-17-30-27-14-5-10-25-40(27)49-44(30)31/h5-39H,3-4H2,1-2H3;5-36H,3-4H2,1-2H3;7-29H,4-6H2,1-3H3;5-26H,3-4H2,1-2H3
• InChIKey: BWCVZCIANOXUNC-UHFFFAOYSA-N
• XLogP: 53.30
• TPSA: 196.27 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 28
• Heavy Atoms: 232
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2990.71
LogP ≤ 5	53.30
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-[4,5-bis(2-ethylbenzimidazol-1-yl)anthracen-9-yl]-2-ethyl-1-phenylbenzimidazole;1-[4,5-bis(1-ethyl-2-phenylbenzimidazol-4-yl)anthracen-9-yl]-9-phenylcarbazole;1-[10-dibenzofuran-4-yl-8-(2-ethylbenzimidazol-1-yl)anthracen-1-yl]-2-ethylbenzimidazole;1-ethyl-4-[8-(1-ethyl-2-phenylbenzimidazol-4-yl)-10-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole?

The IUPAC name of 7-[4,5-bis(2-ethylbenzimidazol-1-yl)anthracen-9-yl]-2-ethyl-1-phenylbenzimidazole;1-[4,5-bis(1-ethyl-2-phenylbenzimidazol-4-yl)anthracen-9-yl]-9-phenylcarbazole;1-[10-dibenzofuran-4-yl-8-(2-ethylbenzimidazol-1-yl)anthracen-1-yl]-2-ethylbenzimidazole;1-ethyl-4-[8-(1-ethyl-2-phenylbenzimidazol-4-yl)-10-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole (CID 157480715) is 7-[4,5-bis(2-ethylbenzimidazol-1-yl)anthracen-9-yl]-2-ethyl-1-phenylbenzimidazole;1-[4,5-bis(1-ethyl-2-phenylbenzimidazol-4-yl)anthracen-9-yl]-9-phenylcarbazole;1-[10-dibenzofuran-4-yl-8-(2-ethylbenzimidazol-1-yl)anthracen-1-yl]-2-ethylbenzimidazole;1-ethyl-4-[8-(1-ethyl-2-phenylbenzimidazol-4-yl)-10-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole.

What is the SMILES notation for 7-[4,5-bis(2-ethylbenzimidazol-1-yl)anthracen-9-yl]-2-ethyl-1-phenylbenzimidazole;1-[4,5-bis(1-ethyl-2-phenylbenzimidazol-4-yl)anthracen-9-yl]-9-phenylcarbazole;1-[10-dibenzofuran-4-yl-8-(2-ethylbenzimidazol-1-yl)anthracen-1-yl]-2-ethylbenzimidazole;1-ethyl-4-[8-(1-ethyl-2-phenylbenzimidazol-4-yl)-10-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole?

The canonical SMILES for 7-[4,5-bis(2-ethylbenzimidazol-1-yl)anthracen-9-yl]-2-ethyl-1-phenylbenzimidazole;1-[4,5-bis(1-ethyl-2-phenylbenzimidazol-4-yl)anthracen-9-yl]-9-phenylcarbazole;1-[10-dibenzofuran-4-yl-8-(2-ethylbenzimidazol-1-yl)anthracen-1-yl]-2-ethylbenzimidazole;1-ethyl-4-[8-(1-ethyl-2-phenylbenzimidazol-4-yl)-10-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole is CCc1nc2ccccc2n1-c1cccc2c(-c3cccc4c3oc3ccccc34)c3cccc(-n4c(CC)nc5ccccc54)c3cc12.CCc1nc2ccccc2n1-c1cccc2c(-c3cccc4nc(CC)n(-c5ccccc5)c34)c3cccc(-n4c(CC)nc5ccccc54)c3cc12.CCn1c(-c2ccccc2)nc2c(-c3cccc4c(-c5cccc6c7ccccc7n(-c7ccccc7)c56)c5cccc(-c6cccc7c6nc(-c6ccccc6)n7CC)c5cc34)cccc21.CCn1c(-c2ccccc2)nc2c(-c3cccc4c(-n5c(-c6ccccc6)nc6ccccc65)c5cccc(-c6cccc7c6nc(-c6ccccc6)n7CC)c5cc34)cccc21.

What is the InChIKey of 7-[4,5-bis(2-ethylbenzimidazol-1-yl)anthracen-9-yl]-2-ethyl-1-phenylbenzimidazole;1-[4,5-bis(1-ethyl-2-phenylbenzimidazol-4-yl)anthracen-9-yl]-9-phenylcarbazole;1-[10-dibenzofuran-4-yl-8-(2-ethylbenzimidazol-1-yl)anthracen-1-yl]-2-ethylbenzimidazole;1-ethyl-4-[8-(1-ethyl-2-phenylbenzimidazol-4-yl)-10-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole?

The InChIKey is BWCVZCIANOXUNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H45N5.C57H42N6.C47H38N6.C44H32N4O/c1-3-65-55-37-19-32-48(58(55)63-61(65)40-21-8-5-9-22-40)43-28-16-30-46-52(43)39-53-44(49-33-20-38-56-59(49)64-62(66(56)4-2)41-23-10-6-11-24-41)29-17-31-47(53)57(46)51-35-18-34-50-45-27-14-15-36-54(45)67(60(50)51)42-25-12-7-13-26-42;1-3-61-50-34-18-28-42(52(50)59-55(61)37-20-8-5-9-21-37)40-26-16-30-44-46(40)36-47-41(43-29-19-35-51-53(43)60-56(62(51)4-2)38-22-10-6-11-23-38)27-17-31-45(47)54(44)63-49-33-15-14-32-48(49)58-57(63)39-24-12-7-13-25-39;1-4-43-50-38-24-14-21-33(47(38)51(43)30-17-8-7-9-18-30)46-31-19-15-27-39(52-41-25-12-10-22-36(41)48-44(52)5-2)34(31)29-35-32(46)20-16-28-40(35)53-42-26-13-11-23-37(42)49-45(53)6-3;1-3-41-45-34-19-6-8-21-38(34)47(41)36-23-12-15-28-32(36)26-33-29(16-13-24-37(33)48-39-22-9-7-20-35(39)46-42(48)4-2)43(28)31-18-11-17-30-27-14-5-10-25-40(27)49-44(30)31/h5-39H,3-4H2,1-2H3;5-36H,3-4H2,1-2H3;7-29H,4-6H2,1-3H3;5-26H,3-4H2,1-2H3.

What are the key properties of 7-[4,5-bis(2-ethylbenzimidazol-1-yl)anthracen-9-yl]-2-ethyl-1-phenylbenzimidazole;1-[4,5-bis(1-ethyl-2-phenylbenzimidazol-4-yl)anthracen-9-yl]-9-phenylcarbazole;1-[10-dibenzofuran-4-yl-8-(2-ethylbenzimidazol-1-yl)anthracen-1-yl]-2-ethylbenzimidazole;1-ethyl-4-[8-(1-ethyl-2-phenylbenzimidazol-4-yl)-10-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole?

7-[4,5-bis(2-ethylbenzimidazol-1-yl)anthracen-9-yl]-2-ethyl-1-phenylbenzimidazole;1-[4,5-bis(1-ethyl-2-phenylbenzimidazol-4-yl)anthracen-9-yl]-9-phenylcarbazole;1-[10-dibenzofuran-4-yl-8-(2-ethylbenzimidazol-1-yl)anthracen-1-yl]-2-ethylbenzimidazole;1-ethyl-4-[8-(1-ethyl-2-phenylbenzimidazol-4-yl)-10-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole has a molecular weight of 2990.71 g/mol, XLogP of 53.30, 28 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 7-[4,5-bis(2-ethylbenzimidazol-1-yl)anthracen-9-yl]-2-ethyl-1-phenylbenzimidazole;1-[4,5-bis(1-ethyl-2-phenylbenzimidazol-4-yl)anthracen-9-yl]-9-phenylcarbazole;1-[10-dibenzofuran-4-yl-8-(2-ethylbenzimidazol-1-yl)anthracen-1-yl]-2-ethylbenzimidazole;1-ethyl-4-[8-(1-ethyl-2-phenylbenzimidazol-4-yl)-10-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole is sourced from PubChem (CID 157480715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).