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

C101H62N8O2 — CID 158611861

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

3-dibenzofuran-2-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-[9-(3-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole (PubChem CID 158611861) has the molecular formula C101H62N8O2 and a molecular weight of 1419.66 g/mol. Its IUPAC name is 3-dibenzofuran-2-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-[9-(3-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole.

Molecular Properties

• Compound Name: 3-dibenzofuran-2-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-[9-(3-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole
• PubChem CID: 158611861
• Molecular Formula: C101H62N8O2
• Molecular Weight: 1419.66 g/mol
• Exact Mass: 1418.50
• IUPAC Name: 3-dibenzofuran-2-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-[9-(3-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole
• SMILES: c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7oc8ccccc8c7c6)ccc54)c3)n2)cc1.c1ccc(-c2nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6cccc7c6oc6ccccc67)c5)ccc43)nc3ccccc23)cc1
• InChI: InChI=1S/C56H34N4O.C45H28N4O/c1-2-14-35(15-3-1)54-45-21-4-8-24-48(45)57-56(58-54)60-50-26-10-6-19-42(50)47-34-37(29-31-52(47)60)36-28-30-51-46(33-36)41-18-5-9-25-49(41)59(51)39-17-12-16-38(32-39)40-22-13-23-44-43-20-7-11-27-53(43)61-55(40)44;1-3-12-29(13-4-1)43-46-44(30-14-5-2-6-15-30)48-45(47-43)33-16-11-17-34(26-33)49-39-20-9-7-18-35(39)37-27-31(22-24-40(37)49)32-23-25-42-38(28-32)36-19-8-10-21-41(36)50-42/h1-34H;1-28H
• InChIKey: HWXWQXQNMISJNY-UHFFFAOYSA-N
• XLogP: 26.26
• TPSA: 105.52 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 10
• Heavy Atoms: 111
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1419.66
LogP ≤ 5	26.26
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Frequently Asked Questions

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

The IUPAC name of 3-dibenzofuran-2-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-[9-(3-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole (CID 158611861) is 3-dibenzofuran-2-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-[9-(3-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole.

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

The canonical SMILES for 3-dibenzofuran-2-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-[9-(3-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole is c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7oc8ccccc8c7c6)ccc54)c3)n2)cc1.c1ccc(-c2nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6cccc7c6oc6ccccc67)c5)ccc43)nc3ccccc23)cc1.

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

The InChIKey is HWXWQXQNMISJNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H34N4O.C45H28N4O/c1-2-14-35(15-3-1)54-45-21-4-8-24-48(45)57-56(58-54)60-50-26-10-6-19-42(50)47-34-37(29-31-52(47)60)36-28-30-51-46(33-36)41-18-5-9-25-49(41)59(51)39-17-12-16-38(32-39)40-22-13-23-44-43-20-7-11-27-53(43)61-55(40)44;1-3-12-29(13-4-1)43-46-44(30-14-5-2-6-15-30)48-45(47-43)33-16-11-17-34(26-33)49-39-20-9-7-18-35(39)37-27-31(22-24-40(37)49)32-23-25-42-38(28-32)36-19-8-10-21-41(36)50-42/h1-34H;1-28H.

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

3-dibenzofuran-2-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-[9-(3-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole has a molecular weight of 1419.66 g/mol, XLogP of 26.26, 10 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 3-dibenzofuran-2-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-[9-(3-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole is sourced from PubChem (CID 158611861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).