3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole

C114H78N2 — CID 177124486

About 3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole

3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole (PubChem CID 177124486) has the molecular formula C114H78N2 and a molecular weight of 1475.89 g/mol. Its IUPAC name is 3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole.

Molecular Properties

• Compound Name: 3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole
• PubChem CID: 177124486
• Molecular Formula: C114H78N2
• Molecular Weight: 1475.89 g/mol
• Exact Mass: 1474.62
• IUPAC Name: 3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole
• SMILES: C1=CC(c2cccc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccc6c(c5)c5cc(-c7ccccc7)ccc5n6-c5cccc(-c6ccc(-c7ccccc7)cc6)c5)ccc43)c2)CC(c2cccc(-c3cc(-c4cccc(-c5ccccc5)c4)cc(-c4cccc(-c5ccc(-c6cccc(-c7ccccc7)c6)cc5)c4)c3)c2)=C1
• InChI: InChI=1S/C114H78N2/c1-6-23-77(24-7-1)82-47-49-85(50-48-82)96-43-21-45-105(71-96)115-111-59-55-98(80-29-12-4-13-30-80)73-107(111)109-75-100(57-61-113(109)115)101-58-62-114-110(76-101)108-74-99(81-31-14-5-15-32-81)56-60-112(108)116(114)106-46-22-44-97(72-106)92-39-19-37-90(66-92)91-38-20-42-95(67-91)104-69-102(93-40-17-34-87(64-93)79-27-10-3-11-28-79)68-103(70-104)94-41-18-36-89(65-94)84-53-51-83(52-54-84)88-35-16-33-86(63-88)78-25-8-2-9-26-78/h1-65,67-76,92H,66H2
• InChIKey: OKMWPHBNSLBLRC-UHFFFAOYSA-N
• XLogP: 31.01
• TPSA: 9.86 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 16
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1475.89
LogP ≤ 5	31.01
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole?

The IUPAC name of 3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole (CID 177124486) is 3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole.

What is the SMILES notation for 3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole?

The canonical SMILES for 3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole is C1=CC(c2cccc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccc6c(c5)c5cc(-c7ccccc7)ccc5n6-c5cccc(-c6ccc(-c7ccccc7)cc6)c5)ccc43)c2)CC(c2cccc(-c3cc(-c4cccc(-c5ccccc5)c4)cc(-c4cccc(-c5ccc(-c6cccc(-c7ccccc7)c6)cc5)c4)c3)c2)=C1.

What is the InChIKey of 3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole?

The InChIKey is OKMWPHBNSLBLRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C114H78N2/c1-6-23-77(24-7-1)82-47-49-85(50-48-82)96-43-21-45-105(71-96)115-111-59-55-98(80-29-12-4-13-30-80)73-107(111)109-75-100(57-61-113(109)115)101-58-62-114-110(76-101)108-74-99(81-31-14-5-15-32-81)56-60-112(108)116(114)106-46-22-44-97(72-106)92-39-19-37-90(66-92)91-38-20-42-95(67-91)104-69-102(93-40-17-34-87(64-93)79-27-10-3-11-28-79)68-103(70-104)94-41-18-36-89(65-94)84-53-51-83(52-54-84)88-35-16-33-86(63-88)78-25-8-2-9-26-78/h1-65,67-76,92H,66H2.

What are the key properties of 3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole?

3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole has a molecular weight of 1475.89 g/mol, XLogP of 31.01, 16 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole is sourced from PubChem (CID 177124486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).