3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole

C84H56N2 — CID 154590713

About 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole

3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole (PubChem CID 154590713) has the molecular formula C84H56N2 and a molecular weight of 1093.39 g/mol. Its IUPAC name is 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole.

Molecular Properties

• Compound Name: 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
• PubChem CID: 154590713
• Molecular Formula: C84H56N2
• Molecular Weight: 1093.39 g/mol
• Exact Mass: 1092.44
• IUPAC Name: 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
• SMILES: c1ccc(-c2ccc(-c3ccc(-c4cccc(-c5cccc(-c6ccc(-c7ccc(-c8ccccc8-n8c9ccccc9c9cc(-c%10ccc%11c(c%10)c%10ccccc%10n%11-c%10ccccc%10-c%10ccccc%10)ccc98)cc7)cc6)c5)c4)cc3)cc2)cc1
• InChI: InChI=1S/C84H56N2/c1-3-17-57(18-4-1)58-33-35-59(36-34-58)60-37-41-63(42-38-60)67-21-15-23-69(53-67)70-24-16-22-68(54-70)64-43-39-61(40-44-64)62-45-47-66(48-46-62)74-26-8-12-30-80(74)86-82-32-14-10-28-76(82)78-56-72(50-52-84(78)86)71-49-51-83-77(55-71)75-27-9-13-31-81(75)85(83)79-29-11-7-25-73(79)65-19-5-2-6-20-65/h1-56H
• InChIKey: OWDJHAJFOCOPSU-UHFFFAOYSA-N
• XLogP: 22.88
• TPSA: 9.86 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 11
• Heavy Atoms: 86
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1093.39
LogP ≤ 5	22.88
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

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

The IUPAC name of 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole (CID 154590713) is 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole.

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

The canonical SMILES for 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole is c1ccc(-c2ccc(-c3ccc(-c4cccc(-c5cccc(-c6ccc(-c7ccc(-c8ccccc8-n8c9ccccc9c9cc(-c%10ccc%11c(c%10)c%10ccccc%10n%11-c%10ccccc%10-c%10ccccc%10)ccc98)cc7)cc6)c5)c4)cc3)cc2)cc1.

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

The InChIKey is OWDJHAJFOCOPSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C84H56N2/c1-3-17-57(18-4-1)58-33-35-59(36-34-58)60-37-41-63(42-38-60)67-21-15-23-69(53-67)70-24-16-22-68(54-70)64-43-39-61(40-44-64)62-45-47-66(48-46-62)74-26-8-12-30-80(74)86-82-32-14-10-28-76(82)78-56-72(50-52-84(78)86)71-49-51-83-77(55-71)75-27-9-13-31-81(75)85(83)79-29-11-7-25-73(79)65-19-5-2-6-20-65/h1-56H.

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

3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole has a molecular weight of 1093.39 g/mol, XLogP of 22.88, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole is sourced from PubChem (CID 154590713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).