9-dibenzofuran-4-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole

C156H96N8O2S2 — CID 160649083

About 9-dibenzofuran-4-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole

9-dibenzofuran-4-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole (PubChem CID 160649083) has the molecular formula C156H96N8O2S2 and a molecular weight of 2178.67 g/mol. Its IUPAC name is 9-dibenzofuran-4-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole.

Molecular Properties

• Compound Name: 9-dibenzofuran-4-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole
• PubChem CID: 160649083
• Molecular Formula: C156H96N8O2S2
• Molecular Weight: 2178.67 g/mol
• Exact Mass: 2176.71
• IUPAC Name: 9-dibenzofuran-4-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole
• SMILES: c1ccc(-n2c3ccccc3c3c4c5ccccc5n(-c5ccc(-c6cccc7c6oc6ccccc67)cc5)c4ccc32)cc1.c1ccc(-n2c3ccccc3c3c4c5ccccc5n(-c5cccc6c5oc5ccccc56)c4ccc32)cc1.c1ccc(-n2c3ccccc3c3cc4c5ccccc5n(-c5ccc(-c6cccc7c6sc6ccccc67)cc5)c4cc32)cc1.c1ccc(-n2c3ccccc3c3cc4c5ccccc5n(-c5cccc6c5sc5ccccc56)c4cc32)cc1
• InChI: InChI=1S/C42H26N2O.C42H26N2S.C36H22N2O.C36H22N2S/c1-2-11-28(12-3-1)43-35-18-7-4-14-33(35)40-37(43)25-26-38-41(40)34-15-5-8-19-36(34)44(38)29-23-21-27(22-24-29)30-16-10-17-32-31-13-6-9-20-39(31)45-42(30)32;1-2-11-28(12-3-1)43-37-18-7-4-13-31(37)35-25-36-32-14-5-8-19-38(32)44(40(36)26-39(35)43)29-23-21-27(22-24-29)30-16-10-17-34-33-15-6-9-20-41(33)45-42(30)34;1-2-11-23(12-3-1)37-28-17-7-4-14-26(28)34-30(37)21-22-31-35(34)27-15-5-8-18-29(27)38(31)32-19-10-16-25-24-13-6-9-20-33(24)39-36(25)32;1-2-11-23(12-3-1)37-30-17-7-4-13-24(30)28-21-29-25-14-5-8-18-31(25)38(34(29)22-33(28)37)32-19-10-16-27-26-15-6-9-20-35(26)39-36(27)32/h2*1-26H;2*1-22H
• InChIKey: RKEGNOFFFJDNGH-UHFFFAOYSA-N
• XLogP: 43.39
• TPSA: 65.72 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 10
• Heavy Atoms: 168
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2178.67
LogP ≤ 5	43.39
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 9-dibenzofuran-4-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole?

The IUPAC name of 9-dibenzofuran-4-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole (CID 160649083) is 9-dibenzofuran-4-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole.

What is the SMILES notation for 9-dibenzofuran-4-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole?

The canonical SMILES for 9-dibenzofuran-4-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole is c1ccc(-n2c3ccccc3c3c4c5ccccc5n(-c5ccc(-c6cccc7c6oc6ccccc67)cc5)c4ccc32)cc1.c1ccc(-n2c3ccccc3c3c4c5ccccc5n(-c5cccc6c5oc5ccccc56)c4ccc32)cc1.c1ccc(-n2c3ccccc3c3cc4c5ccccc5n(-c5ccc(-c6cccc7c6sc6ccccc67)cc5)c4cc32)cc1.c1ccc(-n2c3ccccc3c3cc4c5ccccc5n(-c5cccc6c5sc5ccccc56)c4cc32)cc1.

What is the InChIKey of 9-dibenzofuran-4-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole?

The InChIKey is RKEGNOFFFJDNGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H26N2O.C42H26N2S.C36H22N2O.C36H22N2S/c1-2-11-28(12-3-1)43-35-18-7-4-14-33(35)40-37(43)25-26-38-41(40)34-15-5-8-19-36(34)44(38)29-23-21-27(22-24-29)30-16-10-17-32-31-13-6-9-20-39(31)45-42(30)32;1-2-11-28(12-3-1)43-37-18-7-4-13-31(37)35-25-36-32-14-5-8-19-38(32)44(40(36)26-39(35)43)29-23-21-27(22-24-29)30-16-10-17-34-33-15-6-9-20-41(33)45-42(30)34;1-2-11-23(12-3-1)37-28-17-7-4-14-26(28)34-30(37)21-22-31-35(34)27-15-5-8-18-29(27)38(31)32-19-10-16-25-24-13-6-9-20-33(24)39-36(25)32;1-2-11-23(12-3-1)37-30-17-7-4-13-24(30)28-21-29-25-14-5-8-18-31(25)38(34(29)22-33(28)37)32-19-10-16-27-26-15-6-9-20-35(26)39-36(27)32/h2*1-26H;2*1-22H.

What are the key properties of 9-dibenzofuran-4-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole?

9-dibenzofuran-4-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole has a molecular weight of 2178.67 g/mol, XLogP of 43.39, 10 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 9-dibenzofuran-4-yl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-dibenzothiophen-4-yl-7-phenylindolo[2,3-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole is sourced from PubChem (CID 160649083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).