9-[8-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-3-(2-phenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;bis(9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole);3-(3-dibenzofuran-2-ylphenyl)-9-phenylcarbazole;9-ethyl-3-[3-(9-ethylcarbazol-3-yl)phenyl]carbazole;9-thiophen-2-yl-3-[3-(9-thiophen-2-ylcarbazol-3-yl)phenyl]carbazole;8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene

C329H210N22O4S4 — CID 158000741

About 9-[8-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-3-(2-phenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;bis(9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole);3-(3-dibenzofuran-2-ylphenyl)-9-phenylcarbazole;9-ethyl-3-[3-(9-ethylcarbazol-3-yl)phenyl]carbazole;9-thiophen-2-yl-3-[3-(9-thiophen-2-ylcarbazol-3-yl)phenyl]carbazole;8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene

9-[8-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-3-(2-phenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;bis(9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole);3-(3-dibenzofuran-2-ylphenyl)-9-phenylcarbazole;9-ethyl-3-[3-(9-ethylcarbazol-3-yl)phenyl]carbazole;9-thiophen-2-yl-3-[3-(9-thiophen-2-ylcarbazol-3-yl)phenyl]carbazole;8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene (PubChem CID 158000741) has the molecular formula C329H210N22O4S4 and a molecular weight of 4663.72 g/mol. Its IUPAC name is 9-[8-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-3-(2-phenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;bis(9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole);3-(3-dibenzofuran-2-ylphenyl)-9-phenylcarbazole;9-ethyl-3-[3-(9-ethylcarbazol-3-yl)phenyl]carbazole;9-thiophen-2-yl-3-[3-(9-thiophen-2-ylcarbazol-3-yl)phenyl]carbazole;8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene.

Molecular Properties

• Compound Name: 9-[8-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-3-(2-phenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;bis(9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole);3-(3-dibenzofuran-2-ylphenyl)-9-phenylcarbazole;9-ethyl-3-[3-(9-ethylcarbazol-3-yl)phenyl]carbazole;9-thiophen-2-yl-3-[3-(9-thiophen-2-ylcarbazol-3-yl)phenyl]carbazole;8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
• PubChem CID: 158000741
• Molecular Formula: C329H210N22O4S4
• Molecular Weight: 4663.72 g/mol
• Exact Mass: 4659.58
• IUPAC Name: 9-[8-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-3-(2-phenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;bis(9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole);3-(3-dibenzofuran-2-ylphenyl)-9-phenylcarbazole;9-ethyl-3-[3-(9-ethylcarbazol-3-yl)phenyl]carbazole;9-thiophen-2-yl-3-[3-(9-thiophen-2-ylcarbazol-3-yl)phenyl]carbazole;8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
• SMILES: CCn1c2ccccc2c2cc(-c3cccc(-c4ccc5c(c4)c4ccccc4n5CC)c3)ccc21.c1cc(-c2ccc3c(c2)c2ccccc2n3-c2cccs2)cc(-c2ccc3c(c2)c2ccccc2n3-c2cccs2)c1.c1ccc(-c2ccccc2-c2ccc3c(c2)c2cc(-c4ccccc4-c4ccccn4)ccc2n3-c2ccc3oc4ccc(-n5c6ccc(-c7ccccc7-c7ccccn7)cc6c6cc(-c7ccccc7-c7ccccn7)ccc65)cc4c3c2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc(-c5ccc6oc7ccccc7c6c5)c4)ccc32)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc2oc3ccc(-n4c5ccccc5c5ccccc54)cc3c2c1.c1ccc2c(c1)c1ccccc1n2-c1ccc2sc3ccc(-n4c5ccccc5c5ccccc54)cc3c2c1.c1ccc2c(c1)c1ccccc1n2-c1ccc2sc3ccc(-n4c5ccccc5c5ccccc54)cc3c2c1.c1cnc2c3ncccc3n(-c3ccc4oc5ccc(-n6c7cccnc7c7ncccc76)cc5c4c3)c2c1
• InChI: InChI=1S/C81H51N5O.C38H24N2S2.C36H22N2O.2C36H22N2S.C36H23NO.C34H28N2.C32H18N6O/c1-2-18-52(19-3-1)59-20-4-5-21-60(59)53-31-37-76-67(46-53)68-47-54(61-22-6-9-25-64(61)73-28-12-15-43-82-73)32-38-77(68)85(76)57-35-41-80-71(50-57)72-51-58(36-42-81(72)87-80)86-78-39-33-55(62-23-7-10-26-65(62)74-29-13-16-44-83-74)48-69(78)70-49-56(34-40-79(70)86)63-24-8-11-27-66(63)75-30-14-17-45-84-75;1-3-12-33-29(10-1)31-23-27(16-18-35(31)39(33)37-14-6-20-41-37)25-8-5-9-26(22-25)28-17-19-36-32(24-28)30-11-2-4-13-34(30)40(36)38-15-7-21-42-38;3*1-5-13-31-25(9-1)26-10-2-6-14-32(26)37(31)23-17-19-35-29(21-23)30-22-24(18-20-36(30)39-35)38-33-15-7-3-11-27(33)28-12-4-8-16-34(28)38;1-2-11-28(12-3-1)37-33-15-6-4-13-29(33)31-22-26(17-19-34(31)37)24-9-8-10-25(21-24)27-18-20-36-32(23-27)30-14-5-7-16-35(30)38-36;1-3-35-31-14-7-5-12-27(31)29-21-25(16-18-33(29)35)23-10-9-11-24(20-23)26-17-19-34-30(22-26)28-13-6-8-15-32(28)36(34)4-2;1-5-23-29(33-13-1)30-24(6-2-14-34-30)37(23)19-9-11-27-21(17-19)22-18-20(10-12-28(22)39-27)38-25-7-3-15-35-31(25)32-26(38)8-4-16-36-32/h1-51H;1-24H;3*1-22H;1-23H;5-22H,3-4H2,1-2H3;1-18H
• InChIKey: FDRWXWNHQSDFLA-UHFFFAOYSA-N
• XLogP: 89.57
• TPSA: 216.74 Ų
• H-Bond Acceptors: 30
• Rotatable Bonds: 29
• Heavy Atoms: 359
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4663.72
LogP ≤ 5	89.57
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of 9-[8-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-3-(2-phenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;bis(9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole);3-(3-dibenzofuran-2-ylphenyl)-9-phenylcarbazole;9-ethyl-3-[3-(9-ethylcarbazol-3-yl)phenyl]carbazole;9-thiophen-2-yl-3-[3-(9-thiophen-2-ylcarbazol-3-yl)phenyl]carbazole;8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?

The IUPAC name of 9-[8-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-3-(2-phenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;bis(9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole);3-(3-dibenzofuran-2-ylphenyl)-9-phenylcarbazole;9-ethyl-3-[3-(9-ethylcarbazol-3-yl)phenyl]carbazole;9-thiophen-2-yl-3-[3-(9-thiophen-2-ylcarbazol-3-yl)phenyl]carbazole;8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene (CID 158000741) is 9-[8-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-3-(2-phenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;bis(9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole);3-(3-dibenzofuran-2-ylphenyl)-9-phenylcarbazole;9-ethyl-3-[3-(9-ethylcarbazol-3-yl)phenyl]carbazole;9-thiophen-2-yl-3-[3-(9-thiophen-2-ylcarbazol-3-yl)phenyl]carbazole;8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene.

What is the SMILES notation for 9-[8-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-3-(2-phenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;bis(9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole);3-(3-dibenzofuran-2-ylphenyl)-9-phenylcarbazole;9-ethyl-3-[3-(9-ethylcarbazol-3-yl)phenyl]carbazole;9-thiophen-2-yl-3-[3-(9-thiophen-2-ylcarbazol-3-yl)phenyl]carbazole;8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?

The canonical SMILES for 9-[8-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-3-(2-phenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;bis(9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole);3-(3-dibenzofuran-2-ylphenyl)-9-phenylcarbazole;9-ethyl-3-[3-(9-ethylcarbazol-3-yl)phenyl]carbazole;9-thiophen-2-yl-3-[3-(9-thiophen-2-ylcarbazol-3-yl)phenyl]carbazole;8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene is CCn1c2ccccc2c2cc(-c3cccc(-c4ccc5c(c4)c4ccccc4n5CC)c3)ccc21.c1cc(-c2ccc3c(c2)c2ccccc2n3-c2cccs2)cc(-c2ccc3c(c2)c2ccccc2n3-c2cccs2)c1.c1ccc(-c2ccccc2-c2ccc3c(c2)c2cc(-c4ccccc4-c4ccccn4)ccc2n3-c2ccc3oc4ccc(-n5c6ccc(-c7ccccc7-c7ccccn7)cc6c6cc(-c7ccccc7-c7ccccn7)ccc65)cc4c3c2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc(-c5ccc6oc7ccccc7c6c5)c4)ccc32)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc2oc3ccc(-n4c5ccccc5c5ccccc54)cc3c2c1.c1ccc2c(c1)c1ccccc1n2-c1ccc2sc3ccc(-n4c5ccccc5c5ccccc54)cc3c2c1.c1ccc2c(c1)c1ccccc1n2-c1ccc2sc3ccc(-n4c5ccccc5c5ccccc54)cc3c2c1.c1cnc2c3ncccc3n(-c3ccc4oc5ccc(-n6c7cccnc7c7ncccc76)cc5c4c3)c2c1.

What is the InChIKey of 9-[8-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-3-(2-phenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;bis(9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole);3-(3-dibenzofuran-2-ylphenyl)-9-phenylcarbazole;9-ethyl-3-[3-(9-ethylcarbazol-3-yl)phenyl]carbazole;9-thiophen-2-yl-3-[3-(9-thiophen-2-ylcarbazol-3-yl)phenyl]carbazole;8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?

The InChIKey is FDRWXWNHQSDFLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C81H51N5O.C38H24N2S2.C36H22N2O.2C36H22N2S.C36H23NO.C34H28N2.C32H18N6O/c1-2-18-52(19-3-1)59-20-4-5-21-60(59)53-31-37-76-67(46-53)68-47-54(61-22-6-9-25-64(61)73-28-12-15-43-82-73)32-38-77(68)85(76)57-35-41-80-71(50-57)72-51-58(36-42-81(72)87-80)86-78-39-33-55(62-23-7-10-26-65(62)74-29-13-16-44-83-74)48-69(78)70-49-56(34-40-79(70)86)63-24-8-11-27-66(63)75-30-14-17-45-84-75;1-3-12-33-29(10-1)31-23-27(16-18-35(31)39(33)37-14-6-20-41-37)25-8-5-9-26(22-25)28-17-19-36-32(24-28)30-11-2-4-13-34(30)40(36)38-15-7-21-42-38;3*1-5-13-31-25(9-1)26-10-2-6-14-32(26)37(31)23-17-19-35-29(21-23)30-22-24(18-20-36(30)39-35)38-33-15-7-3-11-27(33)28-12-4-8-16-34(28)38;1-2-11-28(12-3-1)37-33-15-6-4-13-29(33)31-22-26(17-19-34(31)37)24-9-8-10-25(21-24)27-18-20-36-32(23-27)30-14-5-7-16-35(30)38-36;1-3-35-31-14-7-5-12-27(31)29-21-25(16-18-33(29)35)23-10-9-11-24(20-23)26-17-19-34-30(22-26)28-13-6-8-15-32(28)36(34)4-2;1-5-23-29(33-13-1)30-24(6-2-14-34-30)37(23)19-9-11-27-21(17-19)22-18-20(10-12-28(22)39-27)38-25-7-3-15-35-31(25)32-26(38)8-4-16-36-32/h1-51H;1-24H;3*1-22H;1-23H;5-22H,3-4H2,1-2H3;1-18H.

What are the key properties of 9-[8-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-3-(2-phenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;bis(9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole);3-(3-dibenzofuran-2-ylphenyl)-9-phenylcarbazole;9-ethyl-3-[3-(9-ethylcarbazol-3-yl)phenyl]carbazole;9-thiophen-2-yl-3-[3-(9-thiophen-2-ylcarbazol-3-yl)phenyl]carbazole;8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?

9-[8-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-3-(2-phenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;bis(9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole);3-(3-dibenzofuran-2-ylphenyl)-9-phenylcarbazole;9-ethyl-3-[3-(9-ethylcarbazol-3-yl)phenyl]carbazole;9-thiophen-2-yl-3-[3-(9-thiophen-2-ylcarbazol-3-yl)phenyl]carbazole;8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene has a molecular weight of 4663.72 g/mol, XLogP of 89.57, 29 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 9-[8-[3,6-bis(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-3-(2-phenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole;bis(9-(8-carbazol-9-yldibenzothiophen-2-yl)carbazole);3-(3-dibenzofuran-2-ylphenyl)-9-phenylcarbazole;9-ethyl-3-[3-(9-ethylcarbazol-3-yl)phenyl]carbazole;9-thiophen-2-yl-3-[3-(9-thiophen-2-ylcarbazol-3-yl)phenyl]carbazole;8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene is sourced from PubChem (CID 158000741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).