5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole

C130H77N15 — CID 166806150

About 5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole

5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole (PubChem CID 166806150) has the molecular formula C130H77N15 and a molecular weight of 1849.15 g/mol. Its IUPAC name is 5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole.

Molecular Properties

• Compound Name: 5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole
• PubChem CID: 166806150
• Molecular Formula: C130H77N15
• Molecular Weight: 1849.15 g/mol
• Exact Mass: 1847.65
• IUPAC Name: 5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole
• SMILES: c1ccc(-c2nc(-c3cccc(-c4cc5c6ccccc6n(-c6nc(-c7ccc8ccccc8c7)nc(-n7c8ccccc8c8ccc9c%10ccccc%10n(-c%10ccccc%10)c9c87)n6)c5c5c4c4ccccc4n5-c4ccccc4)c3)nc(-n3c4ccc(-n5c6ccccc6c6ccc7c8ccccc8[nH]c7c65)cc4c4cc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8ccccc8)c7c65)ccc43)n2)cc1
• InChI: InChI=1S/C130H77N15/c1-5-33-78(34-6-1)125-132-126(134-128(133-125)143-114-70-62-86(141-109-55-26-16-45-89(109)96-65-64-95-88-44-15-23-52-106(88)131-117(95)118(96)141)74-103(114)104-75-87(63-71-115(104)143)142-110-56-27-19-48-92(110)98-67-66-97-90-46-17-24-53-107(90)138(119(97)120(98)142)83-38-7-2-8-39-83)81-37-31-36-80(73-81)102-76-105-94-50-21-29-58-112(94)145(123(105)124-116(102)101-51-22-30-59-113(101)140(124)85-42-11-4-12-43-85)130-136-127(82-61-60-77-32-13-14-35-79(77)72-82)135-129(137-130)144-111-57-28-20-49-93(111)100-69-68-99-91-47-18-25-54-108(91)139(121(99)122(100)144)84-40-9-3-10-41-84/h1-76,131H
• InChIKey: SUOCOOKXQBXRBR-UHFFFAOYSA-N
• XLogP: 32.29
• TPSA: 132.57 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 14
• Rotatable Bonds: 12
• Heavy Atoms: 145
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1849.15
LogP ≤ 5	32.29
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of 5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole?

The IUPAC name of 5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole (CID 166806150) is 5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole.

What is the SMILES notation for 5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole?

The canonical SMILES for 5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole is c1ccc(-c2nc(-c3cccc(-c4cc5c6ccccc6n(-c6nc(-c7ccc8ccccc8c7)nc(-n7c8ccccc8c8ccc9c%10ccccc%10n(-c%10ccccc%10)c9c87)n6)c5c5c4c4ccccc4n5-c4ccccc4)c3)nc(-n3c4ccc(-n5c6ccccc6c6ccc7c8ccccc8[nH]c7c65)cc4c4cc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8ccccc8)c7c65)ccc43)n2)cc1.

What is the InChIKey of 5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole?

The InChIKey is SUOCOOKXQBXRBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C130H77N15/c1-5-33-78(34-6-1)125-132-126(134-128(133-125)143-114-70-62-86(141-109-55-26-16-45-89(109)96-65-64-95-88-44-15-23-52-106(88)131-117(95)118(96)141)74-103(114)104-75-87(63-71-115(104)143)142-110-56-27-19-48-92(110)98-67-66-97-90-46-17-24-53-107(90)138(119(97)120(98)142)83-38-7-2-8-39-83)81-37-31-36-80(73-81)102-76-105-94-50-21-29-58-112(94)145(123(105)124-116(102)101-51-22-30-59-113(101)140(124)85-42-11-4-12-43-85)130-136-127(82-61-60-77-32-13-14-35-79(77)72-82)135-129(137-130)144-111-57-28-20-49-93(111)100-69-68-99-91-47-18-25-54-108(91)139(121(99)122(100)144)84-40-9-3-10-41-84/h1-76,131H.

What are the key properties of 5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole?

5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole has a molecular weight of 1849.15 g/mol, XLogP of 32.29, 12 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole is sourced from PubChem (CID 166806150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).