4-[9-[2-carbazol-9-yl-3-[4-[3-[4-[3-[9-[2-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-phenylcarbazole

C126H78N12 — CID 146325103

About 4-[9-[2-carbazol-9-yl-3-[4-[3-[4-[3-[9-[2-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-phenylcarbazole

4-[9-[2-carbazol-9-yl-3-[4-[3-[4-[3-[9-[2-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-phenylcarbazole (PubChem CID 146325103) has the molecular formula C126H78N12 and a molecular weight of 1760.09 g/mol. Its IUPAC name is 4-[9-[2-carbazol-9-yl-3-[4-[3-[4-[3-[9-[2-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-phenylcarbazole.

Molecular Properties

• Compound Name: 4-[9-[2-carbazol-9-yl-3-[4-[3-[4-[3-[9-[2-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-phenylcarbazole
• PubChem CID: 146325103
• Molecular Formula: C126H78N12
• Molecular Weight: 1760.09 g/mol
• Exact Mass: 1758.65
• IUPAC Name: 4-[9-[2-carbazol-9-yl-3-[4-[3-[4-[3-[9-[2-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-phenylcarbazole
• SMILES: c1ccc(-c2nc(-c3cccc(-c4ccc(-n5c6ccccc6c6cc(-c7cccc8c7c7ccccc7n8-c7cccc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c7-n7c8ccccc8c8ccccc87)ccc65)cc4)c3)nc(-c3cccc(-n4c5ccccc5c5ccc(-c6cccc7c6c6ccccc6n7-c6ccccc6)cc54)c3-n3c4ccccc4c4ccccc43)n2)cc1
• InChI: InChI=1S/C126H78N12/c1-5-34-80(35-6-1)121-127-122(81-36-7-2-8-37-81)130-125(129-121)100-54-32-66-114(119(100)137-105-58-23-14-44-91(105)92-45-15-24-59-106(92)137)135-110-63-28-20-51-99(110)118-89(52-31-65-113(118)135)84-71-75-111-102(77-84)96-49-18-21-56-103(96)133(111)88-72-68-79(69-73-88)83-40-29-41-86(76-83)124-128-123(82-38-9-3-10-39-82)131-126(132-124)101-55-33-67-115(120(101)138-107-60-25-16-46-93(107)94-47-17-26-61-108(94)138)136-104-57-22-13-48-95(104)97-74-70-85(78-116(97)136)90-53-30-64-112-117(90)98-50-19-27-62-109(98)134(112)87-42-11-4-12-43-87/h1-78H
• InChIKey: WACSGNDTQQZLLO-UHFFFAOYSA-N
• XLogP: 31.64
• TPSA: 106.92 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 15
• Heavy Atoms: 138
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1760.09
LogP ≤ 5	31.64
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

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

The IUPAC name of 4-[9-[2-carbazol-9-yl-3-[4-[3-[4-[3-[9-[2-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-phenylcarbazole (CID 146325103) is 4-[9-[2-carbazol-9-yl-3-[4-[3-[4-[3-[9-[2-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-phenylcarbazole.

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

The canonical SMILES for 4-[9-[2-carbazol-9-yl-3-[4-[3-[4-[3-[9-[2-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-phenylcarbazole is c1ccc(-c2nc(-c3cccc(-c4ccc(-n5c6ccccc6c6cc(-c7cccc8c7c7ccccc7n8-c7cccc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c7-n7c8ccccc8c8ccccc87)ccc65)cc4)c3)nc(-c3cccc(-n4c5ccccc5c5ccc(-c6cccc7c6c6ccccc6n7-c6ccccc6)cc54)c3-n3c4ccccc4c4ccccc43)n2)cc1.

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

The InChIKey is WACSGNDTQQZLLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C126H78N12/c1-5-34-80(35-6-1)121-127-122(81-36-7-2-8-37-81)130-125(129-121)100-54-32-66-114(119(100)137-105-58-23-14-44-91(105)92-45-15-24-59-106(92)137)135-110-63-28-20-51-99(110)118-89(52-31-65-113(118)135)84-71-75-111-102(77-84)96-49-18-21-56-103(96)133(111)88-72-68-79(69-73-88)83-40-29-41-86(76-83)124-128-123(82-38-9-3-10-39-82)131-126(132-124)101-55-33-67-115(120(101)138-107-60-25-16-46-93(107)94-47-17-26-61-108(94)138)136-104-57-22-13-48-95(104)97-74-70-85(78-116(97)136)90-53-30-64-112-117(90)98-50-19-27-62-109(98)134(112)87-42-11-4-12-43-87/h1-78H.

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

4-[9-[2-carbazol-9-yl-3-[4-[3-[4-[3-[9-[2-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-phenylcarbazole has a molecular weight of 1760.09 g/mol, XLogP of 31.64, 15 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[9-[2-carbazol-9-yl-3-[4-[3-[4-[3-[9-[2-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-phenylcarbazole is sourced from PubChem (CID 146325103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).