9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole

C116H72N8 — CID 122677106

About 9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole

9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole (PubChem CID 122677106) has the molecular formula C116H72N8 and a molecular weight of 1577.91 g/mol. Its IUPAC name is 9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole.

Molecular Properties

• Compound Name: 9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole
• PubChem CID: 122677106
• Molecular Formula: C116H72N8
• Molecular Weight: 1577.91 g/mol
• Exact Mass: 1576.59
• IUPAC Name: 9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole
• SMILES: c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)c6ccccc6n7-c6cccc(-c7nc(-c8cccc(-n9c%10ccccc%10c%10cc(-c%11ccc%12c(c%11)c%11cc(-c%13ccc%14c(c%13)c%13ccccc%13n%14-c%13ccccc%13)ccc%11n%12-c%11ccccc%11)ccc%109)c8)c8ccccc8n7)c6)ccc4n5-c4ccccc4)ccc32)cc1
• InChI: InChI=1S/C116H72N8/c1-5-27-83(28-6-1)119-103-43-19-14-37-89(103)94-65-73(47-55-107(94)119)77-51-59-111-98(69-77)100-71-79(53-61-113(100)121(111)85-31-9-3-10-32-85)75-49-57-109-96(67-75)91-39-16-21-45-105(91)123(109)87-35-23-25-81(63-87)115-93-41-13-18-42-102(93)117-116(118-115)82-26-24-36-88(64-82)124-106-46-22-17-40-92(106)97-68-76(50-58-110(97)124)80-54-62-114-101(72-80)99-70-78(52-60-112(99)122(114)86-33-11-4-12-34-86)74-48-56-108-95(66-74)90-38-15-20-44-104(90)120(108)84-29-7-2-8-30-84/h1-72H
• InChIKey: FKXLDDZOWIXQTP-UHFFFAOYSA-N
• XLogP: 30.21
• TPSA: 55.36 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 12
• Heavy Atoms: 124
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1577.91
LogP ≤ 5	30.21
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole?

The IUPAC name of 9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole (CID 122677106) is 9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole.

What is the SMILES notation for 9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole?

The canonical SMILES for 9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole is c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)c6ccccc6n7-c6cccc(-c7nc(-c8cccc(-n9c%10ccccc%10c%10cc(-c%11ccc%12c(c%11)c%11cc(-c%13ccc%14c(c%13)c%13ccccc%13n%14-c%13ccccc%13)ccc%11n%12-c%11ccccc%11)ccc%109)c8)c8ccccc8n7)c6)ccc4n5-c4ccccc4)ccc32)cc1.

What is the InChIKey of 9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole?

The InChIKey is FKXLDDZOWIXQTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C116H72N8/c1-5-27-83(28-6-1)119-103-43-19-14-37-89(103)94-65-73(47-55-107(94)119)77-51-59-111-98(69-77)100-71-79(53-61-113(100)121(111)85-31-9-3-10-32-85)75-49-57-109-96(67-75)91-39-16-21-45-105(91)123(109)87-35-23-25-81(63-87)115-93-41-13-18-42-102(93)117-116(118-115)82-26-24-36-88(64-82)124-106-46-22-17-40-92(106)97-68-76(50-58-110(97)124)80-54-62-114-101(72-80)99-70-78(52-60-112(99)122(114)86-33-11-4-12-34-86)74-48-56-108-95(66-74)90-38-15-20-44-104(90)120(108)84-29-7-2-8-30-84/h1-72H.

What are the key properties of 9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole?

9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole has a molecular weight of 1577.91 g/mol, XLogP of 30.21, 12 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole is sourced from PubChem (CID 122677106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).