5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole

C73H46N8 — CID 169037384

About 5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole

5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole (PubChem CID 169037384) has the molecular formula C73H46N8 and a molecular weight of 1035.23 g/mol. Its IUPAC name is 5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole.

Molecular Properties

• Compound Name: 5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole
• PubChem CID: 169037384
• Molecular Formula: C73H46N8
• Molecular Weight: 1035.23 g/mol
• Exact Mass: 1034.38
• IUPAC Name: 5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole
• SMILES: c1ccc(-c2nc(-c3ccccc3-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c34)nc(-c3cccc4c3C(c3ccccc3)(c3ccccc3)c3ccccc3-4)n2)cc1
• InChI: InChI=1S/C73H46N8/c1-6-25-47(26-7-1)67-75-70(77-71(76-67)58-40-24-39-54-52-35-16-20-41-59(52)73(65(54)58,50-31-12-4-13-32-50)51-33-14-5-15-34-51)57-38-19-23-44-62(57)80-61-43-22-18-37-56(61)64-63(80)46-45-55-53-36-17-21-42-60(53)81(66(55)64)72-78-68(48-27-8-2-9-28-48)74-69(79-72)49-29-10-3-11-30-49/h1-46H
• InChIKey: ODEHGONXHXKJMO-UHFFFAOYSA-N
• XLogP: 16.95
• TPSA: 87.20 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 9
• Heavy Atoms: 81
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1035.23
LogP ≤ 5	16.95
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole?

The IUPAC name of 5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole (CID 169037384) is 5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole.

What is the SMILES notation for 5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole?

The canonical SMILES for 5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole is c1ccc(-c2nc(-c3ccccc3-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c34)nc(-c3cccc4c3C(c3ccccc3)(c3ccccc3)c3ccccc3-4)n2)cc1.

What is the InChIKey of 5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole?

The InChIKey is ODEHGONXHXKJMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H46N8/c1-6-25-47(26-7-1)67-75-70(77-71(76-67)58-40-24-39-54-52-35-16-20-41-59(52)73(65(54)58,50-31-12-4-13-32-50)51-33-14-5-15-34-51)57-38-19-23-44-62(57)80-61-43-22-18-37-56(61)64-63(80)46-45-55-53-36-17-21-42-60(53)81(66(55)64)72-78-68(48-27-8-2-9-28-48)74-69(79-72)49-29-10-3-11-30-49/h1-46H.

What are the key properties of 5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole?

5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole has a molecular weight of 1035.23 g/mol, XLogP of 16.95, 9 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[2-[4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-c]carbazole is sourced from PubChem (CID 169037384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).