2-[4-[4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(2-pyridin-2-yl-4-pyridinyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyrimidin-5-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole

C224H140N40O6 — CID 157139801

About 2-[4-[4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(2-pyridin-2-yl-4-pyridinyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyrimidin-5-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole

2-[4-[4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(2-pyridin-2-yl-4-pyridinyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyrimidin-5-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole (PubChem CID 157139801) has the molecular formula C224H140N40O6 and a molecular weight of 3487.86 g/mol. Its IUPAC name is 2-[4-[4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(2-pyridin-2-yl-4-pyridinyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyrimidin-5-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole.

Molecular Properties

• Compound Name: 2-[4-[4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(2-pyridin-2-yl-4-pyridinyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyrimidin-5-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole
• PubChem CID: 157139801
• Molecular Formula: C224H140N40O6
• Molecular Weight: 3487.86 g/mol
• Exact Mass: 3485.19
• IUPAC Name: 2-[4-[4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(2-pyridin-2-yl-4-pyridinyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyrimidin-5-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole
• SMILES: c1cc(-c2cncnc2)cc(-c2nc(-c3ccc(-c4nc5ccccc5o4)cc3)nc(-c3cccc(-c4cncnc4)c3)n2)c1.c1ccc(-c2cc(-c3nc(-c4ccc(-c5nc6ccccc6o5)cc4)nc(-c4ccnc(-c5ccccn5)c4)n3)ccn2)nc1.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5nc6ccccc6o5)cc4)nc(-c4cccc(-c5ccccn5)c4)n3)c2)nc1.c1ccc2oc(-c3ccc(-c4nc(-c5ccc(-c6ccncc6)cc5)nc(-c5ccc(-c6ccncc6)cc5)n4)cc3)nc2c1.c1cncc(-c2ccc(-c3nc(-c4ccc(-c5cccnc5)cc4)nc(-c4ccc(-c5nc6ccccc6o5)cc4)n3)cc2)c1.c1cncc(-c2cccc(-c3nc(-c4ccc(-c5nc6ccccc6o5)cc4)nc(-c4cccc(-c5cccnc5)c4)n3)c2)c1
• InChI: InChI=1S/4C38H24N6O.2C36H22N8O/c1-2-14-34-33(13-1)41-38(45-34)26-17-15-25(16-18-26)35-42-36(29-9-3-7-27(21-29)31-11-5-19-39-23-31)44-37(43-35)30-10-4-8-28(22-30)32-12-6-20-40-24-32;1-2-16-34-33(15-1)41-38(45-34)26-19-17-25(18-20-26)35-42-36(29-11-7-9-27(23-29)31-13-3-5-21-39-31)44-37(43-35)30-12-8-10-28(24-30)32-14-4-6-22-40-32;1-2-8-34-33(7-1)41-38(45-34)30-19-17-29(18-20-30)37-43-35(27-13-9-25(10-14-27)31-5-3-21-39-23-31)42-36(44-37)28-15-11-26(12-16-28)32-6-4-22-40-24-32;1-2-4-34-33(3-1)41-38(45-34)32-15-13-31(14-16-32)37-43-35(29-9-5-25(6-10-29)27-17-21-39-22-18-27)42-36(44-37)30-11-7-26(8-12-30)28-19-23-40-24-20-28;1-2-10-32-31(9-1)41-36(45-32)24-13-11-23(12-14-24)33-42-34(27-7-3-5-25(15-27)29-17-37-21-38-18-29)44-35(43-33)28-8-4-6-26(16-28)30-19-39-22-40-20-30;1-2-10-32-29(9-1)41-36(45-32)24-13-11-23(12-14-24)33-42-34(25-15-19-39-30(21-25)27-7-3-5-17-37-27)44-35(43-33)26-16-20-40-31(22-26)28-8-4-6-18-38-28/h4*1-24H;2*1-22H
• InChIKey: AKBGRWVMFHFNJB-UHFFFAOYSA-N
• XLogP: 50.41
• TPSA: 594.44 Ų
• H-Bond Acceptors: 46
• Rotatable Bonds: 36
• Heavy Atoms: 270
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3487.86
LogP ≤ 5	50.41
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	46

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(2-pyridin-2-yl-4-pyridinyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyrimidin-5-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole?

The IUPAC name of 2-[4-[4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(2-pyridin-2-yl-4-pyridinyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyrimidin-5-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole (CID 157139801) is 2-[4-[4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(2-pyridin-2-yl-4-pyridinyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyrimidin-5-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole.

What is the SMILES notation for 2-[4-[4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(2-pyridin-2-yl-4-pyridinyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyrimidin-5-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole?

The canonical SMILES for 2-[4-[4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(2-pyridin-2-yl-4-pyridinyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyrimidin-5-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole is c1cc(-c2cncnc2)cc(-c2nc(-c3ccc(-c4nc5ccccc5o4)cc3)nc(-c3cccc(-c4cncnc4)c3)n2)c1.c1ccc(-c2cc(-c3nc(-c4ccc(-c5nc6ccccc6o5)cc4)nc(-c4ccnc(-c5ccccn5)c4)n3)ccn2)nc1.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5nc6ccccc6o5)cc4)nc(-c4cccc(-c5ccccn5)c4)n3)c2)nc1.c1ccc2oc(-c3ccc(-c4nc(-c5ccc(-c6ccncc6)cc5)nc(-c5ccc(-c6ccncc6)cc5)n4)cc3)nc2c1.c1cncc(-c2ccc(-c3nc(-c4ccc(-c5cccnc5)cc4)nc(-c4ccc(-c5nc6ccccc6o5)cc4)n3)cc2)c1.c1cncc(-c2cccc(-c3nc(-c4ccc(-c5nc6ccccc6o5)cc4)nc(-c4cccc(-c5cccnc5)c4)n3)c2)c1.

What is the InChIKey of 2-[4-[4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(2-pyridin-2-yl-4-pyridinyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyrimidin-5-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole?

The InChIKey is AKBGRWVMFHFNJB-UHFFFAOYSA-N. The full InChI is InChI=1S/4C38H24N6O.2C36H22N8O/c1-2-14-34-33(13-1)41-38(45-34)26-17-15-25(16-18-26)35-42-36(29-9-3-7-27(21-29)31-11-5-19-39-23-31)44-37(43-35)30-10-4-8-28(22-30)32-12-6-20-40-24-32;1-2-16-34-33(15-1)41-38(45-34)26-19-17-25(18-20-26)35-42-36(29-11-7-9-27(23-29)31-13-3-5-21-39-31)44-37(43-35)30-12-8-10-28(24-30)32-14-4-6-22-40-32;1-2-8-34-33(7-1)41-38(45-34)30-19-17-29(18-20-30)37-43-35(27-13-9-25(10-14-27)31-5-3-21-39-23-31)42-36(44-37)28-15-11-26(12-16-28)32-6-4-22-40-24-32;1-2-4-34-33(3-1)41-38(45-34)32-15-13-31(14-16-32)37-43-35(29-9-5-25(6-10-29)27-17-21-39-22-18-27)42-36(44-37)30-11-7-26(8-12-30)28-19-23-40-24-20-28;1-2-10-32-31(9-1)41-36(45-32)24-13-11-23(12-14-24)33-42-34(27-7-3-5-25(15-27)29-17-37-21-38-18-29)44-35(43-33)28-8-4-6-26(16-28)30-19-39-22-40-20-30;1-2-10-32-29(9-1)41-36(45-32)24-13-11-23(12-14-24)33-42-34(25-15-19-39-30(21-25)27-7-3-5-17-37-27)44-35(43-33)26-16-20-40-31(22-26)28-8-4-6-18-38-28/h4*1-24H;2*1-22H.

What are the key properties of 2-[4-[4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(2-pyridin-2-yl-4-pyridinyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyrimidin-5-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole?

2-[4-[4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(2-pyridin-2-yl-4-pyridinyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyrimidin-5-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole has a molecular weight of 3487.86 g/mol, XLogP of 50.41, 36 rotatable bonds, 0 hydrogen bond donors, and 46 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-[4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(2-pyridin-2-yl-4-pyridinyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4,6-bis(3-pyrimidin-5-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole is sourced from PubChem (CID 157139801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).