2-dibenzofuran-4-yl-4-[2-[3-[4-[4-dibenzofuran-4-yl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]-3-naphthalen-1-ylnaphthalen-1-yl]phenyl]naphthalen-1-yl]-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine

C98H58N6O2 — CID 155481155

About 2-dibenzofuran-4-yl-4-[2-[3-[4-[4-dibenzofuran-4-yl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]-3-naphthalen-1-ylnaphthalen-1-yl]phenyl]naphthalen-1-yl]-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine

2-dibenzofuran-4-yl-4-[2-[3-[4-[4-dibenzofuran-4-yl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]-3-naphthalen-1-ylnaphthalen-1-yl]phenyl]naphthalen-1-yl]-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine (PubChem CID 155481155) has the molecular formula C98H58N6O2 and a molecular weight of 1351.58 g/mol. Its IUPAC name is 2-dibenzofuran-4-yl-4-[2-[3-[4-[4-dibenzofuran-4-yl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]-3-naphthalen-1-ylnaphthalen-1-yl]phenyl]naphthalen-1-yl]-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine.

Molecular Properties

• Compound Name: 2-dibenzofuran-4-yl-4-[2-[3-[4-[4-dibenzofuran-4-yl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]-3-naphthalen-1-ylnaphthalen-1-yl]phenyl]naphthalen-1-yl]-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine
• PubChem CID: 155481155
• Molecular Formula: C98H58N6O2
• Molecular Weight: 1351.58 g/mol
• Exact Mass: 1350.46
• IUPAC Name: 2-dibenzofuran-4-yl-4-[2-[3-[4-[4-dibenzofuran-4-yl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]-3-naphthalen-1-ylnaphthalen-1-yl]phenyl]naphthalen-1-yl]-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine
• SMILES: c1ccc(-c2ccc3ccccc3c2-c2nc(-c3c(-c4cccc(-c5cc(-c6cccc7ccccc67)c(-c6nc(-c7c(-c8ccccc8)ccc8ccccc78)nc(-c7cccc8c7oc7ccccc78)n6)c6ccccc56)c4)ccc4ccccc34)nc(-c3cccc4c3oc3ccccc34)n2)cc1
• InChI: InChI=1S/C98H58N6O2/c1-3-25-60(26-4-1)71-54-51-62-30-8-12-37-68(62)87(71)95-99-93(81-47-23-45-79-76-41-17-19-49-85(76)105-91(79)81)101-97(103-95)89-70-39-14-10-32-64(70)53-56-73(89)65-34-21-35-66(57-65)83-58-84(74-44-22-33-59-29-7-11-36-67(59)74)90(78-43-16-15-40-75(78)83)98-102-94(82-48-24-46-80-77-42-18-20-50-86(77)106-92(80)82)100-96(104-98)88-69-38-13-9-31-63(69)52-55-72(88)61-27-5-2-6-28-61/h1-58H
• InChIKey: VCXFZTVSQBHZRX-UHFFFAOYSA-N
• XLogP: 25.96
• TPSA: 103.62 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 11
• Heavy Atoms: 106
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1351.58
LogP ≤ 5	25.96
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-4-yl-4-[2-[3-[4-[4-dibenzofuran-4-yl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]-3-naphthalen-1-ylnaphthalen-1-yl]phenyl]naphthalen-1-yl]-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine?

The IUPAC name of 2-dibenzofuran-4-yl-4-[2-[3-[4-[4-dibenzofuran-4-yl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]-3-naphthalen-1-ylnaphthalen-1-yl]phenyl]naphthalen-1-yl]-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine (CID 155481155) is 2-dibenzofuran-4-yl-4-[2-[3-[4-[4-dibenzofuran-4-yl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]-3-naphthalen-1-ylnaphthalen-1-yl]phenyl]naphthalen-1-yl]-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine.

What is the SMILES notation for 2-dibenzofuran-4-yl-4-[2-[3-[4-[4-dibenzofuran-4-yl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]-3-naphthalen-1-ylnaphthalen-1-yl]phenyl]naphthalen-1-yl]-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine?

The canonical SMILES for 2-dibenzofuran-4-yl-4-[2-[3-[4-[4-dibenzofuran-4-yl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]-3-naphthalen-1-ylnaphthalen-1-yl]phenyl]naphthalen-1-yl]-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine is c1ccc(-c2ccc3ccccc3c2-c2nc(-c3c(-c4cccc(-c5cc(-c6cccc7ccccc67)c(-c6nc(-c7c(-c8ccccc8)ccc8ccccc78)nc(-c7cccc8c7oc7ccccc78)n6)c6ccccc56)c4)ccc4ccccc34)nc(-c3cccc4c3oc3ccccc34)n2)cc1.

What is the InChIKey of 2-dibenzofuran-4-yl-4-[2-[3-[4-[4-dibenzofuran-4-yl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]-3-naphthalen-1-ylnaphthalen-1-yl]phenyl]naphthalen-1-yl]-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine?

The InChIKey is VCXFZTVSQBHZRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C98H58N6O2/c1-3-25-60(26-4-1)71-54-51-62-30-8-12-37-68(62)87(71)95-99-93(81-47-23-45-79-76-41-17-19-49-85(76)105-91(79)81)101-97(103-95)89-70-39-14-10-32-64(70)53-56-73(89)65-34-21-35-66(57-65)83-58-84(74-44-22-33-59-29-7-11-36-67(59)74)90(78-43-16-15-40-75(78)83)98-102-94(82-48-24-46-80-77-42-18-20-50-86(77)106-92(80)82)100-96(104-98)88-69-38-13-9-31-63(69)52-55-72(88)61-27-5-2-6-28-61/h1-58H.

What are the key properties of 2-dibenzofuran-4-yl-4-[2-[3-[4-[4-dibenzofuran-4-yl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]-3-naphthalen-1-ylnaphthalen-1-yl]phenyl]naphthalen-1-yl]-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine?

2-dibenzofuran-4-yl-4-[2-[3-[4-[4-dibenzofuran-4-yl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]-3-naphthalen-1-ylnaphthalen-1-yl]phenyl]naphthalen-1-yl]-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine has a molecular weight of 1351.58 g/mol, XLogP of 25.96, 11 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 2-dibenzofuran-4-yl-4-[2-[3-[4-[4-dibenzofuran-4-yl-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]-3-naphthalen-1-ylnaphthalen-1-yl]phenyl]naphthalen-1-yl]-6-(2-phenylnaphthalen-1-yl)-1,3,5-triazine is sourced from PubChem (CID 155481155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).