3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole

C102H58N8O4 — CID 170140037

About 3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole

3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole (PubChem CID 170140037) has the molecular formula C102H58N8O4 and a molecular weight of 1459.64 g/mol. Its IUPAC name is 3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole.

Molecular Properties

• Compound Name: 3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole
• PubChem CID: 170140037
• Molecular Formula: C102H58N8O4
• Molecular Weight: 1459.64 g/mol
• Exact Mass: 1458.46
• IUPAC Name: 3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole
• SMILES: c1ccc(-c2nc(-c3ccc4c(c3)oc3cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc34)nc(-c3cccc4c3oc3ccc(-c5ccc(-c6nc(-c7ccc8c(c7)oc7ccccc78)nc(-c7ccc8c(c7)oc7cc(-c9ccc%10c(c9)c9ccccc9n%10-c9ccccc9)ccc78)n6)cc5)cc34)n2)cc1
• InChI: InChI=1S/C102H58N8O4/c1-4-17-60(18-5-1)97-103-101(69-39-47-79-77-44-36-66(55-92(77)113-95(79)58-69)64-41-49-88-83(52-64)73-24-11-14-29-86(73)110(88)71-21-8-3-9-22-71)108-102(107-97)81-27-16-26-80-84-53-62(42-50-90(84)114-96(80)81)59-31-33-61(34-32-59)98-104-99(67-37-45-75-74-25-12-15-30-89(74)111-93(75)56-67)106-100(105-98)68-38-46-78-76-43-35-65(54-91(76)112-94(78)57-68)63-40-48-87-82(51-63)72-23-10-13-28-85(72)109(87)70-19-6-2-7-20-70/h1-58H
• InChIKey: RDOOSHDAXVXBIF-UHFFFAOYSA-N
• XLogP: 26.85
• TPSA: 139.76 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 11
• Heavy Atoms: 114
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1459.64
LogP ≤ 5	26.85
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole?

The IUPAC name of 3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole (CID 170140037) is 3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole.

What is the SMILES notation for 3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole?

The canonical SMILES for 3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole is c1ccc(-c2nc(-c3ccc4c(c3)oc3cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc34)nc(-c3cccc4c3oc3ccc(-c5ccc(-c6nc(-c7ccc8c(c7)oc7ccccc78)nc(-c7ccc8c(c7)oc7cc(-c9ccc%10c(c9)c9ccccc9n%10-c9ccccc9)ccc78)n6)cc5)cc34)n2)cc1.

What is the InChIKey of 3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole?

The InChIKey is RDOOSHDAXVXBIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C102H58N8O4/c1-4-17-60(18-5-1)97-103-101(69-39-47-79-77-44-36-66(55-92(77)113-95(79)58-69)64-41-49-88-83(52-64)73-24-11-14-29-86(73)110(88)71-21-8-3-9-22-71)108-102(107-97)81-27-16-26-80-84-53-62(42-50-90(84)114-96(80)81)59-31-33-61(34-32-59)98-104-99(67-37-45-75-74-25-12-15-30-89(74)111-93(75)56-67)106-100(105-98)68-38-46-78-76-43-35-65(54-91(76)112-94(78)57-68)63-40-48-87-82(51-63)72-23-10-13-28-85(72)109(87)70-19-6-2-7-20-70/h1-58H.

What are the key properties of 3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole?

3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole has a molecular weight of 1459.64 g/mol, XLogP of 26.85, 11 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole is sourced from PubChem (CID 170140037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).