3-[3-(benzimidazolo[1,2-a]quinolin-6-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzimidazolo[1,2-a]quinoline;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]benzimidazolo[1,2-a]quinoline;6-[4-[2-phenyl-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]benzimidazolo[1,2-a]quinoline

C169H105N21O — CID 164978322

About 3-[3-(benzimidazolo[1,2-a]quinolin-6-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzimidazolo[1,2-a]quinoline;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]benzimidazolo[1,2-a]quinoline;6-[4-[2-phenyl-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]benzimidazolo[1,2-a]quinoline

3-[3-(benzimidazolo[1,2-a]quinolin-6-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzimidazolo[1,2-a]quinoline;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]benzimidazolo[1,2-a]quinoline;6-[4-[2-phenyl-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]benzimidazolo[1,2-a]quinoline (PubChem CID 164978322) has the molecular formula C169H105N21O and a molecular weight of 2445.84 g/mol. Its IUPAC name is 3-[3-(benzimidazolo[1,2-a]quinolin-6-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzimidazolo[1,2-a]quinoline;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]benzimidazolo[1,2-a]quinoline;6-[4-[2-phenyl-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]benzimidazolo[1,2-a]quinoline.

Molecular Properties

• Compound Name: 3-[3-(benzimidazolo[1,2-a]quinolin-6-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzimidazolo[1,2-a]quinoline;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]benzimidazolo[1,2-a]quinoline;6-[4-[2-phenyl-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]benzimidazolo[1,2-a]quinoline
• PubChem CID: 164978322
• Molecular Formula: C169H105N21O
• Molecular Weight: 2445.84 g/mol
• Exact Mass: 2443.88
• IUPAC Name: 3-[3-(benzimidazolo[1,2-a]quinolin-6-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzimidazolo[1,2-a]quinoline;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]benzimidazolo[1,2-a]quinoline;6-[4-[2-phenyl-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]benzimidazolo[1,2-a]quinoline
• SMILES: N#Cc1cccc(-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3cc4ccccc4n4c3nc3ccccc34)c2)c1.c1ccc(-c2nc(-c3ccc(-c4cc5ccccc5n5c4nc4ccccc45)cc3)cc(-c3ccccc3-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4cc5ccccc5n5c4nc4ccccc45)c3)nc(-c3ccc4c(c3)oc3ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cccnc4)cc(-c4cc5ccccc5n5c4nc4ccccc45)c3)n2)cc1
• InChI: InChI=1S/C43H26N6.C43H28N4.C42H25N5O.C41H26N6/c44-27-28-12-11-18-31(22-28)33-23-34(36-26-32-17-7-9-20-38(32)49-39-21-10-8-19-37(39)45-43(36)49)25-35(24-33)42-47-40(29-13-3-1-4-14-29)46-41(48-42)30-15-5-2-6-16-30;1-3-13-29(14-4-1)34-18-8-9-19-35(34)39-28-38(44-42(45-39)32-15-5-2-6-16-32)31-25-23-30(24-26-31)36-27-33-17-7-11-21-40(33)47-41-22-12-10-20-37(41)46-43(36)47;1-2-11-26(12-3-1)39-44-40(46-41(45-39)30-21-22-32-31-16-5-9-20-37(31)48-38(32)25-30)29-15-10-14-27(23-29)33-24-28-13-4-7-18-35(28)47-36-19-8-6-17-34(36)43-42(33)47;1-3-12-27(13-4-1)38-44-39(28-14-5-2-6-15-28)46-40(45-38)33-23-31(30-17-11-21-42-26-30)22-32(24-33)34-25-29-16-7-9-19-36(29)47-37-20-10-8-18-35(37)43-41(34)47/h1-26H;1-28H;1-25H;1-26H
• InChIKey: FCNCGNMWFSEFKF-UHFFFAOYSA-N
• XLogP: 40.75
• TPSA: 260.81 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 19
• Heavy Atoms: 191
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2445.84
LogP ≤ 5	40.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 3-[3-(benzimidazolo[1,2-a]quinolin-6-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzimidazolo[1,2-a]quinoline;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]benzimidazolo[1,2-a]quinoline;6-[4-[2-phenyl-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]benzimidazolo[1,2-a]quinoline?

The IUPAC name of 3-[3-(benzimidazolo[1,2-a]quinolin-6-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzimidazolo[1,2-a]quinoline;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]benzimidazolo[1,2-a]quinoline;6-[4-[2-phenyl-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]benzimidazolo[1,2-a]quinoline (CID 164978322) is 3-[3-(benzimidazolo[1,2-a]quinolin-6-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzimidazolo[1,2-a]quinoline;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]benzimidazolo[1,2-a]quinoline;6-[4-[2-phenyl-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]benzimidazolo[1,2-a]quinoline.

What is the SMILES notation for 3-[3-(benzimidazolo[1,2-a]quinolin-6-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzimidazolo[1,2-a]quinoline;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]benzimidazolo[1,2-a]quinoline;6-[4-[2-phenyl-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]benzimidazolo[1,2-a]quinoline?

The canonical SMILES for 3-[3-(benzimidazolo[1,2-a]quinolin-6-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzimidazolo[1,2-a]quinoline;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]benzimidazolo[1,2-a]quinoline;6-[4-[2-phenyl-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]benzimidazolo[1,2-a]quinoline is N#Cc1cccc(-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3cc4ccccc4n4c3nc3ccccc34)c2)c1.c1ccc(-c2nc(-c3ccc(-c4cc5ccccc5n5c4nc4ccccc45)cc3)cc(-c3ccccc3-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4cc5ccccc5n5c4nc4ccccc45)c3)nc(-c3ccc4c(c3)oc3ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cccnc4)cc(-c4cc5ccccc5n5c4nc4ccccc45)c3)n2)cc1.

What is the InChIKey of 3-[3-(benzimidazolo[1,2-a]quinolin-6-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzimidazolo[1,2-a]quinoline;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]benzimidazolo[1,2-a]quinoline;6-[4-[2-phenyl-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]benzimidazolo[1,2-a]quinoline?

The InChIKey is FCNCGNMWFSEFKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H26N6.C43H28N4.C42H25N5O.C41H26N6/c44-27-28-12-11-18-31(22-28)33-23-34(36-26-32-17-7-9-20-38(32)49-39-21-10-8-19-37(39)45-43(36)49)25-35(24-33)42-47-40(29-13-3-1-4-14-29)46-41(48-42)30-15-5-2-6-16-30;1-3-13-29(14-4-1)34-18-8-9-19-35(34)39-28-38(44-42(45-39)32-15-5-2-6-16-32)31-25-23-30(24-26-31)36-27-33-17-7-11-21-40(33)47-41-22-12-10-20-37(41)46-43(36)47;1-2-11-26(12-3-1)39-44-40(46-41(45-39)30-21-22-32-31-16-5-9-20-37(31)48-38(32)25-30)29-15-10-14-27(23-29)33-24-28-13-4-7-18-35(28)47-36-19-8-6-17-34(36)43-42(33)47;1-3-12-27(13-4-1)38-44-39(28-14-5-2-6-15-28)46-40(45-38)33-23-31(30-17-11-21-42-26-30)22-32(24-33)34-25-29-16-7-9-19-36(29)47-37-20-10-8-18-35(37)43-41(34)47/h1-26H;1-28H;1-25H;1-26H.

What are the key properties of 3-[3-(benzimidazolo[1,2-a]quinolin-6-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzimidazolo[1,2-a]quinoline;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]benzimidazolo[1,2-a]quinoline;6-[4-[2-phenyl-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]benzimidazolo[1,2-a]quinoline?

3-[3-(benzimidazolo[1,2-a]quinolin-6-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzimidazolo[1,2-a]quinoline;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]benzimidazolo[1,2-a]quinoline;6-[4-[2-phenyl-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]benzimidazolo[1,2-a]quinoline has a molecular weight of 2445.84 g/mol, XLogP of 40.75, 19 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[3-(benzimidazolo[1,2-a]quinolin-6-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;6-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzimidazolo[1,2-a]quinoline;6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-3-ylphenyl]benzimidazolo[1,2-a]quinoline;6-[4-[2-phenyl-6-(2-phenylphenyl)pyrimidin-4-yl]phenyl]benzimidazolo[1,2-a]quinoline is sourced from PubChem (CID 164978322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).