2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole

C114H72N8OS — CID 165073222

About 2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole

2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole (PubChem CID 165073222) has the molecular formula C114H72N8OS and a molecular weight of 1601.95 g/mol. Its IUPAC name is 2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole.

Molecular Properties

• Compound Name: 2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole
• PubChem CID: 165073222
• Molecular Formula: C114H72N8OS
• Molecular Weight: 1601.95 g/mol
• Exact Mass: 1600.55
• IUPAC Name: 2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole
• SMILES: c1ccc(-c2cccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccc(-n6c7ccccc7c7ccc(-c8cccc9c8oc8ccccc89)cc76)c(-c6ccccc6)c5)n4)c3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccc(-c6cccc7c6sc6ccccc67)cc54)c(-c4ccccc4)c3)n2)cc1
• InChI: InChI=1S/C63H40N4O.C51H32N4S/c1-4-17-41(18-5-1)44-23-14-24-45(37-44)46-25-15-26-48(38-46)62-64-61(43-21-8-3-9-22-43)65-63(66-62)49-34-36-57(55(39-49)42-19-6-2-7-20-42)67-56-31-12-10-27-51(56)52-35-33-47(40-58(52)67)50-29-16-30-54-53-28-11-13-32-59(53)68-60(50)54;1-4-15-33(16-5-1)43-31-37(51-53-49(34-17-6-2-7-18-34)52-50(54-51)35-19-8-3-9-20-35)28-30-45(43)55-44-25-12-10-21-39(44)40-29-27-36(32-46(40)55)38-23-14-24-42-41-22-11-13-26-47(41)56-48(38)42/h1-40H;1-32H
• InChIKey: TWKIXISWILEKTG-UHFFFAOYSA-N
• XLogP: 30.21
• TPSA: 100.34 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 14
• Heavy Atoms: 124
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1601.95
LogP ≤ 5	30.21
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole?

The IUPAC name of 2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole (CID 165073222) is 2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole.

What is the SMILES notation for 2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole?

The canonical SMILES for 2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole is c1ccc(-c2cccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccc(-n6c7ccccc7c7ccc(-c8cccc9c8oc8ccccc89)cc76)c(-c6ccccc6)c5)n4)c3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccc(-c6cccc7c6sc6ccccc67)cc54)c(-c4ccccc4)c3)n2)cc1.

What is the InChIKey of 2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole?

The InChIKey is TWKIXISWILEKTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H40N4O.C51H32N4S/c1-4-17-41(18-5-1)44-23-14-24-45(37-44)46-25-15-26-48(38-46)62-64-61(43-21-8-3-9-22-43)65-63(66-62)49-34-36-57(55(39-49)42-19-6-2-7-20-42)67-56-31-12-10-27-51(56)52-35-33-47(40-58(52)67)50-29-16-30-54-53-28-11-13-32-59(53)68-60(50)54;1-4-15-33(16-5-1)43-31-37(51-53-49(34-17-6-2-7-18-34)52-50(54-51)35-19-8-3-9-20-35)28-30-45(43)55-44-25-12-10-21-39(44)40-29-27-36(32-46(40)55)38-23-14-24-42-41-22-11-13-26-47(41)56-48(38)42/h1-40H;1-32H.

What are the key properties of 2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole?

2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole has a molecular weight of 1601.95 g/mol, XLogP of 30.21, 14 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole is sourced from PubChem (CID 165073222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).