11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-5-[7-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12-phenylindolo[2,3-a]carbazole

C108H64N12 — CID 166947040

About 11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-5-[7-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12-phenylindolo[2,3-a]carbazole

11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-5-[7-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12-phenylindolo[2,3-a]carbazole (PubChem CID 166947040) has the molecular formula C108H64N12 and a molecular weight of 1529.78 g/mol. Its IUPAC name is 11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-5-[7-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12-phenylindolo[2,3-a]carbazole.

Molecular Properties

• Compound Name: 11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-5-[7-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12-phenylindolo[2,3-a]carbazole
• PubChem CID: 166947040
• Molecular Formula: C108H64N12
• Molecular Weight: 1529.78 g/mol
• Exact Mass: 1528.54
• IUPAC Name: 11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-5-[7-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12-phenylindolo[2,3-a]carbazole
• SMILES: c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5nc(-c6ccc7ccccc7c6)nc(-c6ccc7ccc(-c8cc9c%10ccccc%10n(-c%10nc(-c%11ccc%12ccccc%12c%11)nc(-n%11c%12ccccc%12c%12ccc%13c%14ccccc%14n(-c%14ccccc%14)c%13c%12%11)n%10)c9c9c8c8ccccc8n9-c8ccccc8)cc7c6)n5)c4c32)cc1
• InChI: InChI=1S/C108H64N12/c1-4-30-75(31-5-1)115-90-42-20-14-36-78(90)83-56-58-85-80-38-16-22-44-92(80)118(99(85)97(83)115)106-110-103(71-53-49-65-26-10-12-28-68(65)60-71)109-104(111-106)73-55-51-67-48-52-70(62-74(67)63-73)88-64-89-82-40-18-24-46-94(82)120(101(89)102-96(88)87-41-19-25-47-95(87)117(102)77-34-8-3-9-35-77)108-113-105(72-54-50-66-27-11-13-29-69(66)61-72)112-107(114-108)119-93-45-23-17-39-81(93)86-59-57-84-79-37-15-21-43-91(79)116(98(84)100(86)119)76-32-6-2-7-33-76/h1-64H
• InChIKey: BDTGQXXOFCHNLF-UHFFFAOYSA-N
• XLogP: 26.77
• TPSA: 106.92 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 10
• Heavy Atoms: 120
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1529.78
LogP ≤ 5	26.77
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-5-[7-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12-phenylindolo[2,3-a]carbazole?

The IUPAC name of 11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-5-[7-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12-phenylindolo[2,3-a]carbazole (CID 166947040) is 11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-5-[7-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12-phenylindolo[2,3-a]carbazole.

What is the SMILES notation for 11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-5-[7-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12-phenylindolo[2,3-a]carbazole?

The canonical SMILES for 11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-5-[7-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12-phenylindolo[2,3-a]carbazole is c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5nc(-c6ccc7ccccc7c6)nc(-c6ccc7ccc(-c8cc9c%10ccccc%10n(-c%10nc(-c%11ccc%12ccccc%12c%11)nc(-n%11c%12ccccc%12c%12ccc%13c%14ccccc%14n(-c%14ccccc%14)c%13c%12%11)n%10)c9c9c8c8ccccc8n9-c8ccccc8)cc7c6)n5)c4c32)cc1.

What is the InChIKey of 11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-5-[7-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12-phenylindolo[2,3-a]carbazole?

The InChIKey is BDTGQXXOFCHNLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C108H64N12/c1-4-30-75(31-5-1)115-90-42-20-14-36-78(90)83-56-58-85-80-38-16-22-44-92(80)118(99(85)97(83)115)106-110-103(71-53-49-65-26-10-12-28-68(65)60-71)109-104(111-106)73-55-51-67-48-52-70(62-74(67)63-73)88-64-89-82-40-18-24-46-94(82)120(101(89)102-96(88)87-41-19-25-47-95(87)117(102)77-34-8-3-9-35-77)108-113-105(72-54-50-66-27-11-13-29-69(66)61-72)112-107(114-108)119-93-45-23-17-39-81(93)86-59-57-84-79-37-15-21-43-91(79)116(98(84)100(86)119)76-32-6-2-7-33-76/h1-64H.

What are the key properties of 11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-5-[7-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12-phenylindolo[2,3-a]carbazole?

11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-5-[7-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12-phenylindolo[2,3-a]carbazole has a molecular weight of 1529.78 g/mol, XLogP of 26.77, 10 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-5-[7-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12-phenylindolo[2,3-a]carbazole is sourced from PubChem (CID 166947040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).