5-[3-[4-[3-(3,5-diphenylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenyl-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole

C78H51N7 — CID 129265397

About 5-[3-[4-[3-(3,5-diphenylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenyl-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole

5-[3-[4-[3-(3,5-diphenylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenyl-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole (PubChem CID 129265397) has the molecular formula C78H51N7 and a molecular weight of 1086.32 g/mol. Its IUPAC name is 5-[3-[4-[3-(3,5-diphenylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenyl-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole.

Molecular Properties

• Compound Name: 5-[3-[4-[3-(3,5-diphenylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenyl-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole
• PubChem CID: 129265397
• Molecular Formula: C78H51N7
• Molecular Weight: 1086.32 g/mol
• Exact Mass: 1085.42
• IUPAC Name: 5-[3-[4-[3-(3,5-diphenylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenyl-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole
• SMILES: c1ccc(-c2cc(-c3ccccc3)cc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5cccc(-c6cccc7c6c6cc(-c8ccccc8)ccc6n7-c6nc(-c7ccccc7)nc(-c7cccc(-c8ccccc8)c7)n6)c5)n4)c3)c2)cc1
• InChI: InChI=1S/C78H51N7/c1-7-23-52(24-8-1)58-35-19-39-63(45-58)77-81-74(57-33-17-6-18-34-57)83-78(84-77)85-70-44-43-60(53-25-9-2-10-26-53)51-69(70)72-68(41-22-42-71(72)85)61-37-21-40-64(47-61)76-80-73(56-31-15-5-16-32-56)79-75(82-76)62-38-20-36-59(46-62)67-49-65(54-27-11-3-12-28-54)48-66(50-67)55-29-13-4-14-30-55/h1-51H
• InChIKey: IUADVLHKWUGYFB-UHFFFAOYSA-N
• XLogP: 19.49
• TPSA: 82.27 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 12
• Heavy Atoms: 85
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1086.32
LogP ≤ 5	19.49
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

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

The IUPAC name of 5-[3-[4-[3-(3,5-diphenylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenyl-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole (CID 129265397) is 5-[3-[4-[3-(3,5-diphenylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenyl-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole.

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

The canonical SMILES for 5-[3-[4-[3-(3,5-diphenylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenyl-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole is c1ccc(-c2cc(-c3ccccc3)cc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5cccc(-c6cccc7c6c6cc(-c8ccccc8)ccc6n7-c6nc(-c7ccccc7)nc(-c7cccc(-c8ccccc8)c7)n6)c5)n4)c3)c2)cc1.

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

The InChIKey is IUADVLHKWUGYFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C78H51N7/c1-7-23-52(24-8-1)58-35-19-39-63(45-58)77-81-74(57-33-17-6-18-34-57)83-78(84-77)85-70-44-43-60(53-25-9-2-10-26-53)51-69(70)72-68(41-22-42-71(72)85)61-37-21-40-64(47-61)76-80-73(56-31-15-5-16-32-56)79-75(82-76)62-38-20-36-59(46-62)67-49-65(54-27-11-3-12-28-54)48-66(50-67)55-29-13-4-14-30-55/h1-51H.

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

5-[3-[4-[3-(3,5-diphenylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenyl-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole has a molecular weight of 1086.32 g/mol, XLogP of 19.49, 12 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[3-[4-[3-(3,5-diphenylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3-phenyl-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole is sourced from PubChem (CID 129265397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).