2-cyclohexa-1,5-dien-1-yl-4-naphthalen-2-yl-6-[2-[4-[3-[4-[4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]-1,3,5-triazine

C102H64N6O2 — CID 155442651

About 2-cyclohexa-1,5-dien-1-yl-4-naphthalen-2-yl-6-[2-[4-[3-[4-[4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]-1,3,5-triazine

2-cyclohexa-1,5-dien-1-yl-4-naphthalen-2-yl-6-[2-[4-[3-[4-[4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]-1,3,5-triazine (PubChem CID 155442651) has the molecular formula C102H64N6O2 and a molecular weight of 1405.67 g/mol. Its IUPAC name is 2-cyclohexa-1,5-dien-1-yl-4-naphthalen-2-yl-6-[2-[4-[3-[4-[4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]-1,3,5-triazine.

Molecular Properties

• Compound Name: 2-cyclohexa-1,5-dien-1-yl-4-naphthalen-2-yl-6-[2-[4-[3-[4-[4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]-1,3,5-triazine
• PubChem CID: 155442651
• Molecular Formula: C102H64N6O2
• Molecular Weight: 1405.67 g/mol
• Exact Mass: 1404.51
• IUPAC Name: 2-cyclohexa-1,5-dien-1-yl-4-naphthalen-2-yl-6-[2-[4-[3-[4-[4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]-1,3,5-triazine
• SMILES: C1=CC(c2nc(-c3ccc4ccccc4c3)nc(-c3ccccc3-c3ccc4c(c3)C3(c5ccccc5O4)c4ccccc4-c4c(-c5cccc(-c6ccc(-c7nc(-c8ccccc8)nc(-c8ccccc8-c8ccc9c(c8)C8(c%10ccccc%10O9)c9ccccc9-c9ccccc98)n7)cc6)c5)cccc43)n2)=CCC1
• InChI: InChI=1S/C102H64N6O2/c1-3-26-65(27-4-1)95-103-97(107-99(105-95)79-37-11-9-33-74(79)71-55-57-92-88(61-71)101(85-44-19-21-47-90(85)109-92)82-41-16-13-35-77(82)78-36-14-17-42-83(78)101)67-52-49-64(50-53-67)69-31-23-32-70(59-69)76-40-24-46-87-94(76)81-39-15-18-43-84(81)102(87)86-45-20-22-48-91(86)110-93-58-56-72(62-89(93)102)75-34-10-12-38-80(75)100-106-96(66-28-5-2-6-29-66)104-98(108-100)73-54-51-63-25-7-8-30-68(63)60-73/h1,3-5,7-62H,2,6H2
• InChIKey: QRSDHBNRYIHVDC-UHFFFAOYSA-N
• XLogP: 24.88
• TPSA: 95.80 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 10
• Heavy Atoms: 110
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1405.67
LogP ≤ 5	24.88
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexa-1,5-dien-1-yl-4-naphthalen-2-yl-6-[2-[4-[3-[4-[4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]-1,3,5-triazine?

The IUPAC name of 2-cyclohexa-1,5-dien-1-yl-4-naphthalen-2-yl-6-[2-[4-[3-[4-[4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]-1,3,5-triazine (CID 155442651) is 2-cyclohexa-1,5-dien-1-yl-4-naphthalen-2-yl-6-[2-[4-[3-[4-[4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]-1,3,5-triazine.

What is the SMILES notation for 2-cyclohexa-1,5-dien-1-yl-4-naphthalen-2-yl-6-[2-[4-[3-[4-[4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]-1,3,5-triazine?

The canonical SMILES for 2-cyclohexa-1,5-dien-1-yl-4-naphthalen-2-yl-6-[2-[4-[3-[4-[4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]-1,3,5-triazine is C1=CC(c2nc(-c3ccc4ccccc4c3)nc(-c3ccccc3-c3ccc4c(c3)C3(c5ccccc5O4)c4ccccc4-c4c(-c5cccc(-c6ccc(-c7nc(-c8ccccc8)nc(-c8ccccc8-c8ccc9c(c8)C8(c%10ccccc%10O9)c9ccccc9-c9ccccc98)n7)cc6)c5)cccc43)n2)=CCC1.

What is the InChIKey of 2-cyclohexa-1,5-dien-1-yl-4-naphthalen-2-yl-6-[2-[4-[3-[4-[4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]-1,3,5-triazine?

The InChIKey is QRSDHBNRYIHVDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C102H64N6O2/c1-3-26-65(27-4-1)95-103-97(107-99(105-95)79-37-11-9-33-74(79)71-55-57-92-88(61-71)101(85-44-19-21-47-90(85)109-92)82-41-16-13-35-77(82)78-36-14-17-42-83(78)101)67-52-49-64(50-53-67)69-31-23-32-70(59-69)76-40-24-46-87-94(76)81-39-15-18-43-84(81)102(87)86-45-20-22-48-91(86)110-93-58-56-72(62-89(93)102)75-34-10-12-38-80(75)100-106-96(66-28-5-2-6-29-66)104-98(108-100)73-54-51-63-25-7-8-30-68(63)60-73/h1,3-5,7-62H,2,6H2.

What are the key properties of 2-cyclohexa-1,5-dien-1-yl-4-naphthalen-2-yl-6-[2-[4-[3-[4-[4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]-1,3,5-triazine?

2-cyclohexa-1,5-dien-1-yl-4-naphthalen-2-yl-6-[2-[4-[3-[4-[4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]-1,3,5-triazine has a molecular weight of 1405.67 g/mol, XLogP of 24.88, 10 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 2-cyclohexa-1,5-dien-1-yl-4-naphthalen-2-yl-6-[2-[4-[3-[4-[4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]spiro[fluorene-9,9'-xanthene]-2'-yl]phenyl]-1,3,5-triazine is sourced from PubChem (CID 155442651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).