6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole

C176H110Cl2N24 — CID 161031543

About 6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole

6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole (PubChem CID 161031543) has the molecular formula C176H110Cl2N24 and a molecular weight of 2631.89 g/mol. Its IUPAC name is 6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole.

Molecular Properties

• Compound Name: 6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole
• PubChem CID: 161031543
• Molecular Formula: C176H110Cl2N24
• Molecular Weight: 2631.89 g/mol
• Exact Mass: 2628.87
• IUPAC Name: 6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole
• SMILES: Clc1ccc2c(c1)c1ccncc1n2-c1ccc(-c2cc(-c3ccc(-n4c5ccc(Cl)cc5c5ccncc54)cc3)nc(-c3ccccn3)c2)cc1.c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5cnccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5cnccc54)cc3)n2)nc1.c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5ncccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5ncccc54)cc3)n2)nc1.c1ccc(-c2cc(-c3cccc(-n4c5ccccc5c5cccnc54)c3)cc(-c3cccc(-n4c5ccccc5c5cccnc54)c3)n2)nc1
• InChI: InChI=1S/C44H26Cl2N6.3C44H28N6/c45-30-8-14-41-36(23-30)34-16-19-47-25-43(34)51(41)32-10-4-27(5-11-32)29-21-39(50-40(22-29)38-3-1-2-18-49-38)28-6-12-33(13-7-28)52-42-15-9-31(46)24-37(42)35-17-20-48-26-44(35)52;1-3-20-41-34(15-1)36-17-9-23-46-43(36)49(41)32-13-7-11-29(25-32)31-27-39(48-40(28-31)38-19-5-6-22-45-38)30-12-8-14-33(26-30)50-42-21-4-2-16-35(42)37-18-10-24-47-44(37)50;1-3-12-39-34(9-1)43-41(14-7-25-46-43)49(39)32-20-16-29(17-21-32)31-27-37(48-38(28-31)36-11-5-6-24-45-36)30-18-22-33(23-19-30)50-40-13-4-2-10-35(40)44-42(50)15-8-26-47-44;1-3-10-41-34(7-1)36-27-45-23-20-43(36)49(41)32-16-12-29(13-17-32)31-25-39(48-40(26-31)38-9-5-6-22-47-38)30-14-18-33(19-15-30)50-42-11-4-2-8-35(42)37-28-46-24-21-44(37)50/h1-26H;3*1-28H
• InChIKey: TZRMAOMUVGVOCV-UHFFFAOYSA-N
• XLogP: 43.15
• TPSA: 245.68 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 20
• Heavy Atoms: 202
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2631.89
LogP ≤ 5	43.15
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole?

The IUPAC name of 6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole (CID 161031543) is 6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole.

What is the SMILES notation for 6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole?

The canonical SMILES for 6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole is Clc1ccc2c(c1)c1ccncc1n2-c1ccc(-c2cc(-c3ccc(-n4c5ccc(Cl)cc5c5ccncc54)cc3)nc(-c3ccccn3)c2)cc1.c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5cnccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5cnccc54)cc3)n2)nc1.c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5ncccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5ncccc54)cc3)n2)nc1.c1ccc(-c2cc(-c3cccc(-n4c5ccccc5c5cccnc54)c3)cc(-c3cccc(-n4c5ccccc5c5cccnc54)c3)n2)nc1.

What is the InChIKey of 6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole?

The InChIKey is TZRMAOMUVGVOCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H26Cl2N6.3C44H28N6/c45-30-8-14-41-36(23-30)34-16-19-47-25-43(34)51(41)32-10-4-27(5-11-32)29-21-39(50-40(22-29)38-3-1-2-18-49-38)28-6-12-33(13-7-28)52-42-15-9-31(46)24-37(42)35-17-20-48-26-44(35)52;1-3-20-41-34(15-1)36-17-9-23-46-43(36)49(41)32-13-7-11-29(25-32)31-27-39(48-40(28-31)38-19-5-6-22-45-38)30-12-8-14-33(26-30)50-42-21-4-2-16-35(42)37-18-10-24-47-44(37)50;1-3-12-39-34(9-1)43-41(14-7-25-46-43)49(39)32-20-16-29(17-21-32)31-27-37(48-38(28-31)36-11-5-6-24-45-36)30-18-22-33(23-19-30)50-40-13-4-2-10-35(40)44-42(50)15-8-26-47-44;1-3-10-41-34(7-1)36-27-45-23-20-43(36)49(41)32-16-12-29(13-17-32)31-25-39(48-40(26-31)38-9-5-6-22-47-38)30-14-18-33(19-15-30)50-42-11-4-2-8-35(42)37-28-46-24-21-44(37)50/h1-26H;3*1-28H.

What are the key properties of 6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole?

6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole has a molecular weight of 2631.89 g/mol, XLogP of 43.15, 20 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 6-chloro-9-[4-[2-[4-(6-chloropyrido[3,4-b]indol-9-yl)phenyl]-6-pyridin-2-yl-4-pyridinyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[3,2-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[2-pyridin-2-yl-6-(4-pyrido[4,3-b]indol-5-ylphenyl)-4-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[2-pyridin-2-yl-6-(3-pyrido[2,3-b]indol-9-ylphenyl)-4-pyridinyl]phenyl]pyrido[2,3-b]indole is sourced from PubChem (CID 161031543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).