3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazole;3-[9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole

C156H94N10 — CID 160886437

About 3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazole;3-[9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole

3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazole;3-[9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole (PubChem CID 160886437) has the molecular formula C156H94N10 and a molecular weight of 2108.54 g/mol. Its IUPAC name is 3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazole;3-[9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole.

Molecular Properties

• Compound Name: 3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazole;3-[9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole
• PubChem CID: 160886437
• Molecular Formula: C156H94N10
• Molecular Weight: 2108.54 g/mol
• Exact Mass: 2106.77
• IUPAC Name: 3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazole;3-[9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole
• SMILES: c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5nc(-c6ccc7c8ccccc8c8ccccc8c7c6)nc(-c6ccc7c8ccccc8c8ccccc8c7c6)n5)ccc43)c2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5nc(-c6ccc7c8ccccc8c8ccccc8c7c6)nc(-c6ccc7c8ccccc8c8ccccc8c7c6)n5)ccc43)cc2)cc1
• InChI: InChI=1S/C81H49N5.C75H45N5/c1-3-19-50(20-4-1)56-43-57(51-21-5-2-6-22-51)45-58(44-56)85-75-33-17-15-31-69(75)73-46-52(37-41-77(73)85)53-38-42-78-74(47-53)70-32-16-18-34-76(70)86(78)81-83-79(54-35-39-67-63-27-9-7-23-59(63)61-25-11-13-29-65(61)71(67)48-54)82-80(84-81)55-36-40-68-64-28-10-8-24-60(64)62-26-12-14-30-66(62)72(68)49-55;1-2-16-46(17-3-1)47-30-36-52(37-31-47)79-69-28-14-12-26-63(69)67-42-48(34-40-71(67)79)49-35-41-72-68(43-49)64-27-13-15-29-70(64)80(72)75-77-73(50-32-38-61-57-22-6-4-18-53(57)55-20-8-10-24-59(55)65(61)44-50)76-74(78-75)51-33-39-62-58-23-7-5-19-54(58)56-21-9-11-25-60(56)66(62)45-51/h1-49H;1-45H
• InChIKey: SNRSSGHDWAPRFP-UHFFFAOYSA-N
• XLogP: 40.97
• TPSA: 97.06 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 13
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2108.54
LogP ≤ 5	40.97
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazole;3-[9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole?

The IUPAC name of 3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazole;3-[9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole (CID 160886437) is 3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazole;3-[9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole.

What is the SMILES notation for 3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazole;3-[9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole?

The canonical SMILES for 3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazole;3-[9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole is c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5nc(-c6ccc7c8ccccc8c8ccccc8c7c6)nc(-c6ccc7c8ccccc8c8ccccc8c7c6)n5)ccc43)c2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5nc(-c6ccc7c8ccccc8c8ccccc8c7c6)nc(-c6ccc7c8ccccc8c8ccccc8c7c6)n5)ccc43)cc2)cc1.

What is the InChIKey of 3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazole;3-[9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole?

The InChIKey is SNRSSGHDWAPRFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C81H49N5.C75H45N5/c1-3-19-50(20-4-1)56-43-57(51-21-5-2-6-22-51)45-58(44-56)85-75-33-17-15-31-69(75)73-46-52(37-41-77(73)85)53-38-42-78-74(47-53)70-32-16-18-34-76(70)86(78)81-83-79(54-35-39-67-63-27-9-7-23-59(63)61-25-11-13-29-65(61)71(67)48-54)82-80(84-81)55-36-40-68-64-28-10-8-24-60(64)62-26-12-14-30-66(62)72(68)49-55;1-2-16-46(17-3-1)47-30-36-52(37-31-47)79-69-28-14-12-26-63(69)67-42-48(34-40-71(67)79)49-35-41-72-68(43-49)64-27-13-15-29-70(64)80(72)75-77-73(50-32-38-61-57-22-6-4-18-53(57)55-20-8-10-24-59(55)65(61)44-50)76-74(78-75)51-33-39-62-58-23-7-5-19-54(58)56-21-9-11-25-60(56)66(62)45-51/h1-49H;1-45H.

What are the key properties of 3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazole;3-[9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole?

3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazole;3-[9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole has a molecular weight of 2108.54 g/mol, XLogP of 40.97, 13 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazole;3-[9-[4,6-di(triphenylen-2-yl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole is sourced from PubChem (CID 160886437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).