2-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-4-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-5-(6-methyl-2-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine

C138H104N18 — CID 165079372

About 2-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-4-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-5-(6-methyl-2-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine

2-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-4-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-5-(6-methyl-2-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine (PubChem CID 165079372) has the molecular formula C138H104N18 and a molecular weight of 2014.48 g/mol. Its IUPAC name is 2-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-4-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-5-(6-methyl-2-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine.

Molecular Properties

• Compound Name: 2-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-4-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-5-(6-methyl-2-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine
• PubChem CID: 165079372
• Molecular Formula: C138H104N18
• Molecular Weight: 2014.48 g/mol
• Exact Mass: 2012.87
• IUPAC Name: 2-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-4-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-5-(6-methyl-2-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine
• SMILES: C/C=C\C(=C/C)c1nc(-c2ccccc2)nc(-c2cc(-c3cccc(-c4nc5ccccn5c4-c4ccccc4)c3)cc(-c3ccc(C)nc3C)c2)n1.C/C=C\C(=C/C)c1nc(-c2ccccc2)nc(-c2cc(-c3cccc(-c4nc5ccccn5c4-c4ccccc4)c3)cc(-c3cccc(C)n3)c2)n1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4ccncc4)cc(-c4cccc(-c5nc6ccccn6c5-c5ccccc5)c4)c3)n2)cc1
• InChI: InChI=1S/C47H38N6.C46H36N6.C45H30N6/c1-5-16-33(6-2)45-50-46(35-19-11-8-12-20-35)52-47(51-45)40-29-38(28-39(30-40)41-25-24-31(3)48-32(41)4)36-21-15-22-37(27-36)43-44(34-17-9-7-10-18-34)53-26-14-13-23-42(53)49-43;1-4-16-32(5-2)44-49-45(34-20-10-7-11-21-34)51-46(50-44)39-29-37(28-38(30-39)40-24-14-17-31(3)47-40)35-22-15-23-36(27-35)42-43(33-18-8-6-9-19-33)52-26-13-12-25-41(52)48-42;1-4-13-32(14-5-1)42-41(47-40-21-10-11-26-51(40)42)36-20-12-19-35(27-36)38-28-37(31-22-24-46-25-23-31)29-39(30-38)45-49-43(33-15-6-2-7-16-33)48-44(50-45)34-17-8-3-9-18-34/h5-30H,1-4H3;4-30H,1-3H3;1-30H/b16-5-,33-6+;16-4-,32-5+
• InChIKey: UWAJVEXEJWLIND-HCZLJHNKSA-N
• XLogP: 33.30
• TPSA: 206.58 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 23
• Heavy Atoms: 156
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2014.48
LogP ≤ 5	33.30
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-4-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-5-(6-methyl-2-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine?

The IUPAC name of 2-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-4-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-5-(6-methyl-2-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine (CID 165079372) is 2-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-4-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-5-(6-methyl-2-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine.

What is the SMILES notation for 2-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-4-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-5-(6-methyl-2-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine?

The canonical SMILES for 2-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-4-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-5-(6-methyl-2-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine is C/C=C\C(=C/C)c1nc(-c2ccccc2)nc(-c2cc(-c3cccc(-c4nc5ccccn5c4-c4ccccc4)c3)cc(-c3ccc(C)nc3C)c2)n1.C/C=C\C(=C/C)c1nc(-c2ccccc2)nc(-c2cc(-c3cccc(-c4nc5ccccn5c4-c4ccccc4)c3)cc(-c3cccc(C)n3)c2)n1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4ccncc4)cc(-c4cccc(-c5nc6ccccn6c5-c5ccccc5)c4)c3)n2)cc1.

What is the InChIKey of 2-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-4-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-5-(6-methyl-2-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine?

The InChIKey is UWAJVEXEJWLIND-HCZLJHNKSA-N. The full InChI is InChI=1S/C47H38N6.C46H36N6.C45H30N6/c1-5-16-33(6-2)45-50-46(35-19-11-8-12-20-35)52-47(51-45)40-29-38(28-39(30-40)41-25-24-31(3)48-32(41)4)36-21-15-22-37(27-36)43-44(34-17-9-7-10-18-34)53-26-14-13-23-42(53)49-43;1-4-16-32(5-2)44-49-45(34-20-10-7-11-21-34)51-46(50-44)39-29-37(28-38(30-39)40-24-14-17-31(3)47-40)35-22-15-23-36(27-35)42-43(33-18-8-6-9-19-33)52-26-13-12-25-41(52)48-42;1-4-13-32(14-5-1)42-41(47-40-21-10-11-26-51(40)42)36-20-12-19-35(27-36)38-28-37(31-22-24-46-25-23-31)29-39(30-38)45-49-43(33-15-6-2-7-16-33)48-44(50-45)34-17-8-3-9-18-34/h5-30H,1-4H3;4-30H,1-3H3;1-30H/b16-5-,33-6+;16-4-,32-5+;.

What are the key properties of 2-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-4-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-5-(6-methyl-2-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine?

2-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-4-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-5-(6-methyl-2-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine has a molecular weight of 2014.48 g/mol, XLogP of 33.30, 23 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-pyridin-4-ylphenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-[4-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-5-(6-methyl-2-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine is sourced from PubChem (CID 165079372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).