5-[4,6-bis(pyrido[3,2-b]indol-5-yl)-1,3,5-triazin-2-yl]pyrido[3,2-b]indole;8-[3,5-bis(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,7-diphenyl-1,10-phenanthroline;8-(2-pyridin-2-ylphenyl)-5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;8-[8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indol-5-yl]-[1]benzofuro[3,2-b]pyridine;8-[8-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene

C217H128N38O3 — CID 160775042

About 5-[4,6-bis(pyrido[3,2-b]indol-5-yl)-1,3,5-triazin-2-yl]pyrido[3,2-b]indole;8-[3,5-bis(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,7-diphenyl-1,10-phenanthroline;8-(2-pyridin-2-ylphenyl)-5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;8-[8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indol-5-yl]-[1]benzofuro[3,2-b]pyridine;8-[8-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene

5-[4,6-bis(pyrido[3,2-b]indol-5-yl)-1,3,5-triazin-2-yl]pyrido[3,2-b]indole;8-[3,5-bis(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,7-diphenyl-1,10-phenanthroline;8-(2-pyridin-2-ylphenyl)-5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;8-[8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indol-5-yl]-[1]benzofuro[3,2-b]pyridine;8-[8-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene (PubChem CID 160775042) has the molecular formula C217H128N38O3 and a molecular weight of 3315.67 g/mol. Its IUPAC name is 5-[4,6-bis(pyrido[3,2-b]indol-5-yl)-1,3,5-triazin-2-yl]pyrido[3,2-b]indole;8-[3,5-bis(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,7-diphenyl-1,10-phenanthroline;8-(2-pyridin-2-ylphenyl)-5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;8-[8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indol-5-yl]-[1]benzofuro[3,2-b]pyridine;8-[8-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene.

Molecular Properties

• Compound Name: 5-[4,6-bis(pyrido[3,2-b]indol-5-yl)-1,3,5-triazin-2-yl]pyrido[3,2-b]indole;8-[3,5-bis(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,7-diphenyl-1,10-phenanthroline;8-(2-pyridin-2-ylphenyl)-5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;8-[8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indol-5-yl]-[1]benzofuro[3,2-b]pyridine;8-[8-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
• PubChem CID: 160775042
• Molecular Formula: C217H128N38O3
• Molecular Weight: 3315.67 g/mol
• Exact Mass: 3313.10
• IUPAC Name: 5-[4,6-bis(pyrido[3,2-b]indol-5-yl)-1,3,5-triazin-2-yl]pyrido[3,2-b]indole;8-[3,5-bis(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,7-diphenyl-1,10-phenanthroline;8-(2-pyridin-2-ylphenyl)-5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;8-[8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indol-5-yl]-[1]benzofuro[3,2-b]pyridine;8-[8-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
• SMILES: c1cc2c(cn1)c1cnccc1n2-c1cc(-n2c3ccncc3c3cnccc32)cc(-n2c3ccncc3c3cnccc32)c1.c1cc2c(cn1)c1cnccc1n2-c1ccc2oc3ccc(-n4c5ccncc5c5cnccc54)cc3c2c1.c1ccc(-c2ccccc2-c2ccc3c(c2)c2ncccc2n3-c2ccc3oc4ccc(-n5c6ccccc6c6ncccc65)cc4c3c2)nc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc2c(c1)c1ncccc1n2-c1nc(-n2c3ccccc3c3ncccc32)nc(-n2c3ccccc3c3ncccc32)n1.c1cnc2c(c1)oc1ccc(-n3c4ccc(-n5c6ccc(-n7c8ccccc8c8ncccc87)cc6c6ncccc65)cc4c4ncccc43)cc12
• InChI: InChI=1S/C45H27N5O.C44H25N7O.2C36H21N9.C32H18N6O.C24H16N2/c1-2-10-32(37-12-5-6-22-46-37)31(9-1)28-16-19-39-36(25-28)45-41(15-8-24-48-45)50(39)30-18-21-43-35(27-30)34-26-29(17-20-42(34)51-43)49-38-13-4-3-11-33(38)44-40(49)14-7-23-47-44;1-2-8-33-29(7-1)41-36(9-3-19-45-41)49(33)26-13-16-34-30(23-26)42-37(10-4-20-46-42)50(34)27-14-17-35-31(24-27)43-38(11-5-21-47-43)51(35)28-15-18-39-32(25-28)44-40(52-39)12-6-22-48-44;1-7-37-16-25-26-17-38-8-2-32(26)43(31(1)25)22-13-23(44-33-3-9-39-18-27(33)28-19-40-10-4-34(28)44)15-24(14-22)45-35-5-11-41-20-29(35)30-21-42-12-6-36(30)45;1-4-13-25-22(10-1)31-28(16-7-19-37-31)43(25)34-40-35(44-26-14-5-2-11-23(26)32-29(44)17-8-20-38-32)42-36(41-34)45-27-15-6-3-12-24(27)33-30(45)18-9-21-39-33;1-3-31-21(13-19(1)37-27-5-9-33-15-23(27)24-16-34-10-6-28(24)37)22-14-20(2-4-32(22)39-31)38-29-7-11-35-17-25(29)26-18-36-12-8-30(26)38;1-3-7-17(8-4-1)19-13-15-25-23-21(19)11-12-22-20(14-16-26-24(22)23)18-9-5-2-6-10-18/h1-27H;1-25H;2*1-21H;1-18H;1-16H
• InChIKey: RZVGUPJWQYWLGN-UHFFFAOYSA-N
• XLogP: 49.93
• TPSA: 425.76 Ų
• H-Bond Acceptors: 41
• Rotatable Bonds: 17
• Heavy Atoms: 258
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3315.67
LogP ≤ 5	49.93
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	41

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-[4,6-bis(pyrido[3,2-b]indol-5-yl)-1,3,5-triazin-2-yl]pyrido[3,2-b]indole;8-[3,5-bis(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,7-diphenyl-1,10-phenanthroline;8-(2-pyridin-2-ylphenyl)-5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;8-[8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indol-5-yl]-[1]benzofuro[3,2-b]pyridine;8-[8-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?

The IUPAC name of 5-[4,6-bis(pyrido[3,2-b]indol-5-yl)-1,3,5-triazin-2-yl]pyrido[3,2-b]indole;8-[3,5-bis(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,7-diphenyl-1,10-phenanthroline;8-(2-pyridin-2-ylphenyl)-5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;8-[8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indol-5-yl]-[1]benzofuro[3,2-b]pyridine;8-[8-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene (CID 160775042) is 5-[4,6-bis(pyrido[3,2-b]indol-5-yl)-1,3,5-triazin-2-yl]pyrido[3,2-b]indole;8-[3,5-bis(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,7-diphenyl-1,10-phenanthroline;8-(2-pyridin-2-ylphenyl)-5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;8-[8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indol-5-yl]-[1]benzofuro[3,2-b]pyridine;8-[8-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene.

What is the SMILES notation for 5-[4,6-bis(pyrido[3,2-b]indol-5-yl)-1,3,5-triazin-2-yl]pyrido[3,2-b]indole;8-[3,5-bis(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,7-diphenyl-1,10-phenanthroline;8-(2-pyridin-2-ylphenyl)-5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;8-[8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indol-5-yl]-[1]benzofuro[3,2-b]pyridine;8-[8-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?

The canonical SMILES for 5-[4,6-bis(pyrido[3,2-b]indol-5-yl)-1,3,5-triazin-2-yl]pyrido[3,2-b]indole;8-[3,5-bis(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,7-diphenyl-1,10-phenanthroline;8-(2-pyridin-2-ylphenyl)-5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;8-[8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indol-5-yl]-[1]benzofuro[3,2-b]pyridine;8-[8-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene is c1cc2c(cn1)c1cnccc1n2-c1cc(-n2c3ccncc3c3cnccc32)cc(-n2c3ccncc3c3cnccc32)c1.c1cc2c(cn1)c1cnccc1n2-c1ccc2oc3ccc(-n4c5ccncc5c5cnccc54)cc3c2c1.c1ccc(-c2ccccc2-c2ccc3c(c2)c2ncccc2n3-c2ccc3oc4ccc(-n5c6ccccc6c6ncccc65)cc4c3c2)nc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc2c(c1)c1ncccc1n2-c1nc(-n2c3ccccc3c3ncccc32)nc(-n2c3ccccc3c3ncccc32)n1.c1cnc2c(c1)oc1ccc(-n3c4ccc(-n5c6ccc(-n7c8ccccc8c8ncccc87)cc6c6ncccc65)cc4c4ncccc43)cc12.

What is the InChIKey of 5-[4,6-bis(pyrido[3,2-b]indol-5-yl)-1,3,5-triazin-2-yl]pyrido[3,2-b]indole;8-[3,5-bis(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,7-diphenyl-1,10-phenanthroline;8-(2-pyridin-2-ylphenyl)-5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;8-[8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indol-5-yl]-[1]benzofuro[3,2-b]pyridine;8-[8-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?

The InChIKey is RZVGUPJWQYWLGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H27N5O.C44H25N7O.2C36H21N9.C32H18N6O.C24H16N2/c1-2-10-32(37-12-5-6-22-46-37)31(9-1)28-16-19-39-36(25-28)45-41(15-8-24-48-45)50(39)30-18-21-43-35(27-30)34-26-29(17-20-42(34)51-43)49-38-13-4-3-11-33(38)44-40(49)14-7-23-47-44;1-2-8-33-29(7-1)41-36(9-3-19-45-41)49(33)26-13-16-34-30(23-26)42-37(10-4-20-46-42)50(34)27-14-17-35-31(24-27)43-38(11-5-21-47-43)51(35)28-15-18-39-32(25-28)44-40(52-39)12-6-22-48-44;1-7-37-16-25-26-17-38-8-2-32(26)43(31(1)25)22-13-23(44-33-3-9-39-18-27(33)28-19-40-10-4-34(28)44)15-24(14-22)45-35-5-11-41-20-29(35)30-21-42-12-6-36(30)45;1-4-13-25-22(10-1)31-28(16-7-19-37-31)43(25)34-40-35(44-26-14-5-2-11-23(26)32-29(44)17-8-20-38-32)42-36(41-34)45-27-15-6-3-12-24(27)33-30(45)18-9-21-39-33;1-3-31-21(13-19(1)37-27-5-9-33-15-23(27)24-16-34-10-6-28(24)37)22-14-20(2-4-32(22)39-31)38-29-7-11-35-17-25(29)26-18-36-12-8-30(26)38;1-3-7-17(8-4-1)19-13-15-25-23-21(19)11-12-22-20(14-16-26-24(22)23)18-9-5-2-6-10-18/h1-27H;1-25H;2*1-21H;1-18H;1-16H.

What are the key properties of 5-[4,6-bis(pyrido[3,2-b]indol-5-yl)-1,3,5-triazin-2-yl]pyrido[3,2-b]indole;8-[3,5-bis(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,7-diphenyl-1,10-phenanthroline;8-(2-pyridin-2-ylphenyl)-5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;8-[8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indol-5-yl]-[1]benzofuro[3,2-b]pyridine;8-[8-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?

5-[4,6-bis(pyrido[3,2-b]indol-5-yl)-1,3,5-triazin-2-yl]pyrido[3,2-b]indole;8-[3,5-bis(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,7-diphenyl-1,10-phenanthroline;8-(2-pyridin-2-ylphenyl)-5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;8-[8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indol-5-yl]-[1]benzofuro[3,2-b]pyridine;8-[8-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene has a molecular weight of 3315.67 g/mol, XLogP of 49.93, 17 rotatable bonds, 0 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[4,6-bis(pyrido[3,2-b]indol-5-yl)-1,3,5-triazin-2-yl]pyrido[3,2-b]indole;8-[3,5-bis(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,7-diphenyl-1,10-phenanthroline;8-(2-pyridin-2-ylphenyl)-5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;8-[8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indol-5-yl]-[1]benzofuro[3,2-b]pyridine;8-[8-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene is sourced from PubChem (CID 160775042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).