2-[4-[4-[4,6-bis(4-chlorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-chlorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-fluorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis[4-(trifluoromethyl)phenyl]-1,3,5-triazine;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine

C172H106Cl4F10N24 — CID 158443772

About 2-[4-[4-[4,6-bis(4-chlorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-chlorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-fluorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis[4-(trifluoromethyl)phenyl]-1,3,5-triazine;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine

2-[4-[4-[4,6-bis(4-chlorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-chlorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-fluorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis[4-(trifluoromethyl)phenyl]-1,3,5-triazine;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine (PubChem CID 158443772) has the molecular formula C172H106Cl4F10N24 and a molecular weight of 2840.70 g/mol. Its IUPAC name is 2-[4-[4-[4,6-bis(4-chlorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-chlorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-fluorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis[4-(trifluoromethyl)phenyl]-1,3,5-triazine;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine.

Molecular Properties

• Compound Name: 2-[4-[4-[4,6-bis(4-chlorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-chlorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-fluorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis[4-(trifluoromethyl)phenyl]-1,3,5-triazine;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
• PubChem CID: 158443772
• Molecular Formula: C172H106Cl4F10N24
• Molecular Weight: 2840.70 g/mol
• Exact Mass: 2836.76
• IUPAC Name: 2-[4-[4-[4,6-bis(4-chlorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-chlorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-fluorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis[4-(trifluoromethyl)phenyl]-1,3,5-triazine;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
• SMILES: Cc1ccc(-c2nc(-c3ccc(C)cc3)nc(-c3ccc(-c4ccc(-c5nc(-c6ccc(C(F)(F)F)cc6)nc(-c6ccc(C(F)(F)F)cc6)n5)cc4)cc3)n2)cc1.Clc1ccc(-c2nc(-c3ccc(Cl)cc3)nc(-c3ccc(-c4ccc(-c5nc(-c6ccc(Cl)cc6)nc(-c6ccc(Cl)cc6)n5)cc4)cc3)n2)cc1.Fc1ccc(-c2nc(-c3ccc(F)cc3)nc(-c3ccc(-c4ccc(-c5nc(-c6ccc(F)cc6)nc(-c6ccc(F)cc6)n5)cc4)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4)cc3)n2)cc1
• InChI: InChI=1S/C46H30F6N6.C42H24Cl4N6.C42H24F4N6.C42H28N6/c1-27-3-7-31(8-4-27)39-53-40(32-9-5-28(2)6-10-32)55-41(54-39)33-15-11-29(12-16-33)30-13-17-34(18-14-30)42-56-43(35-19-23-37(24-20-35)45(47,48)49)58-44(57-42)36-21-25-38(26-22-36)46(50,51)52;2*43-33-17-9-29(10-18-33)39-47-37(48-40(51-39)30-11-19-34(44)20-12-30)27-5-1-25(2-6-27)26-3-7-28(8-4-26)38-49-41(31-13-21-35(45)22-14-31)52-42(50-38)32-15-23-36(46)24-16-32;1-5-13-31(14-6-1)37-43-38(32-15-7-2-8-16-32)46-41(45-37)35-25-21-29(22-26-35)30-23-27-36(28-24-30)42-47-39(33-17-9-3-10-18-33)44-40(48-42)34-19-11-4-12-20-34/h3-26H,1-2H3;2*1-24H;1-28H
• InChIKey: HDDFGHDGYQQCRJ-UHFFFAOYSA-N
• XLogP: 44.73
• TPSA: 309.36 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 28
• Heavy Atoms: 210
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2840.70
LogP ≤ 5	44.73
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-[4,6-bis(4-chlorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-chlorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-fluorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis[4-(trifluoromethyl)phenyl]-1,3,5-triazine;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine?

The IUPAC name of 2-[4-[4-[4,6-bis(4-chlorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-chlorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-fluorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis[4-(trifluoromethyl)phenyl]-1,3,5-triazine;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine (CID 158443772) is 2-[4-[4-[4,6-bis(4-chlorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-chlorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-fluorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis[4-(trifluoromethyl)phenyl]-1,3,5-triazine;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine.

What is the SMILES notation for 2-[4-[4-[4,6-bis(4-chlorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-chlorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-fluorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis[4-(trifluoromethyl)phenyl]-1,3,5-triazine;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine?

The canonical SMILES for 2-[4-[4-[4,6-bis(4-chlorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-chlorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-fluorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis[4-(trifluoromethyl)phenyl]-1,3,5-triazine;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine is Cc1ccc(-c2nc(-c3ccc(C)cc3)nc(-c3ccc(-c4ccc(-c5nc(-c6ccc(C(F)(F)F)cc6)nc(-c6ccc(C(F)(F)F)cc6)n5)cc4)cc3)n2)cc1.Clc1ccc(-c2nc(-c3ccc(Cl)cc3)nc(-c3ccc(-c4ccc(-c5nc(-c6ccc(Cl)cc6)nc(-c6ccc(Cl)cc6)n5)cc4)cc3)n2)cc1.Fc1ccc(-c2nc(-c3ccc(F)cc3)nc(-c3ccc(-c4ccc(-c5nc(-c6ccc(F)cc6)nc(-c6ccc(F)cc6)n5)cc4)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4)cc3)n2)cc1.

What is the InChIKey of 2-[4-[4-[4,6-bis(4-chlorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-chlorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-fluorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis[4-(trifluoromethyl)phenyl]-1,3,5-triazine;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine?

The InChIKey is HDDFGHDGYQQCRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H30F6N6.C42H24Cl4N6.C42H24F4N6.C42H28N6/c1-27-3-7-31(8-4-27)39-53-40(32-9-5-28(2)6-10-32)55-41(54-39)33-15-11-29(12-16-33)30-13-17-34(18-14-30)42-56-43(35-19-23-37(24-20-35)45(47,48)49)58-44(57-42)36-21-25-38(26-22-36)46(50,51)52;2*43-33-17-9-29(10-18-33)39-47-37(48-40(51-39)30-11-19-34(44)20-12-30)27-5-1-25(2-6-27)26-3-7-28(8-4-26)38-49-41(31-13-21-35(45)22-14-31)52-42(50-38)32-15-23-36(46)24-16-32;1-5-13-31(14-6-1)37-43-38(32-15-7-2-8-16-32)46-41(45-37)35-25-21-29(22-26-35)30-23-27-36(28-24-30)42-47-39(33-17-9-3-10-18-33)44-40(48-42)34-19-11-4-12-20-34/h3-26H,1-2H3;2*1-24H;1-28H.

What are the key properties of 2-[4-[4-[4,6-bis(4-chlorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-chlorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-fluorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis[4-(trifluoromethyl)phenyl]-1,3,5-triazine;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine?

2-[4-[4-[4,6-bis(4-chlorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-chlorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-fluorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis[4-(trifluoromethyl)phenyl]-1,3,5-triazine;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine has a molecular weight of 2840.70 g/mol, XLogP of 44.73, 28 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-[4-[4,6-bis(4-chlorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-chlorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(4-fluorophenyl)-1,3,5-triazine;2-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis[4-(trifluoromethyl)phenyl]-1,3,5-triazine;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine is sourced from PubChem (CID 158443772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).