2-benzo[a]carbazol-11-yl-5-[6-(3-naphthalen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[6-(3-triphenylen-2-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole

C128H76N8 — CID 159658375

About 2-benzo[a]carbazol-11-yl-5-[6-(3-naphthalen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[6-(3-triphenylen-2-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole

2-benzo[a]carbazol-11-yl-5-[6-(3-naphthalen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[6-(3-triphenylen-2-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole (PubChem CID 159658375) has the molecular formula C128H76N8 and a molecular weight of 1726.07 g/mol. Its IUPAC name is 2-benzo[a]carbazol-11-yl-5-[6-(3-naphthalen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[6-(3-triphenylen-2-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole.

Molecular Properties

• Compound Name: 2-benzo[a]carbazol-11-yl-5-[6-(3-naphthalen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[6-(3-triphenylen-2-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole
• PubChem CID: 159658375
• Molecular Formula: C128H76N8
• Molecular Weight: 1726.07 g/mol
• Exact Mass: 1724.62
• IUPAC Name: 2-benzo[a]carbazol-11-yl-5-[6-(3-naphthalen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[6-(3-triphenylen-2-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole
• SMILES: c1ccc2cc3c(cc2c1)c1cc(-n2c4ccccc4c4ccc5ccccc5c42)ccc1n3-c1cccc2cc(-c3nc4ccccc4nc3-c3ccc4c5ccccc5c5ccccc5c4c3)ccc12.c1ccc2cc3c(cc2c1)c1cc(-n2c4ccccc4c4ccc5ccccc5c42)ccc1n3-c1cccc2cc(-c3nc4ccccc4nc3-c3cccc4ccccc34)ccc12
• InChI: InChI=1S/C68H40N4.C60H36N4/c1-2-16-43-39-65-58(37-42(43)15-1)59-40-47(71-63-26-12-9-23-55(63)56-34-28-41-14-3-4-18-49(41)68(56)71)31-35-64(59)72(65)62-27-13-17-44-36-45(29-32-48(44)62)66-67(70-61-25-11-10-24-60(61)69-66)46-30-33-54-52-21-6-5-19-50(52)51-20-7-8-22-53(51)57(54)38-46;1-2-16-40-35-57-50(34-39(40)15-1)51-36-43(63-55-25-10-7-21-47(55)49-31-27-38-14-4-6-20-46(38)60(49)63)29-32-56(51)64(57)54-26-12-18-41-33-42(28-30-45(41)54)58-59(62-53-24-9-8-23-52(53)61-58)48-22-11-17-37-13-3-5-19-44(37)48/h1-40H;1-36H
• InChIKey: MSLTWPKLDKGFSC-UHFFFAOYSA-N
• XLogP: 33.85
• TPSA: 71.28 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 8
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1726.07
LogP ≤ 5	33.85
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-benzo[a]carbazol-11-yl-5-[6-(3-naphthalen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[6-(3-triphenylen-2-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole?

The IUPAC name of 2-benzo[a]carbazol-11-yl-5-[6-(3-naphthalen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[6-(3-triphenylen-2-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole (CID 159658375) is 2-benzo[a]carbazol-11-yl-5-[6-(3-naphthalen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[6-(3-triphenylen-2-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole.

What is the SMILES notation for 2-benzo[a]carbazol-11-yl-5-[6-(3-naphthalen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[6-(3-triphenylen-2-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole?

The canonical SMILES for 2-benzo[a]carbazol-11-yl-5-[6-(3-naphthalen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[6-(3-triphenylen-2-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole is c1ccc2cc3c(cc2c1)c1cc(-n2c4ccccc4c4ccc5ccccc5c42)ccc1n3-c1cccc2cc(-c3nc4ccccc4nc3-c3ccc4c5ccccc5c5ccccc5c4c3)ccc12.c1ccc2cc3c(cc2c1)c1cc(-n2c4ccccc4c4ccc5ccccc5c42)ccc1n3-c1cccc2cc(-c3nc4ccccc4nc3-c3cccc4ccccc34)ccc12.

What is the InChIKey of 2-benzo[a]carbazol-11-yl-5-[6-(3-naphthalen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[6-(3-triphenylen-2-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole?

The InChIKey is MSLTWPKLDKGFSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H40N4.C60H36N4/c1-2-16-43-39-65-58(37-42(43)15-1)59-40-47(71-63-26-12-9-23-55(63)56-34-28-41-14-3-4-18-49(41)68(56)71)31-35-64(59)72(65)62-27-13-17-44-36-45(29-32-48(44)62)66-67(70-61-25-11-10-24-60(61)69-66)46-30-33-54-52-21-6-5-19-50(52)51-20-7-8-22-53(51)57(54)38-46;1-2-16-40-35-57-50(34-39(40)15-1)51-36-43(63-55-25-10-7-21-47(55)49-31-27-38-14-4-6-20-46(38)60(49)63)29-32-56(51)64(57)54-26-12-18-41-33-42(28-30-45(41)54)58-59(62-53-24-9-8-23-52(53)61-58)48-22-11-17-37-13-3-5-19-44(37)48/h1-40H;1-36H.

What are the key properties of 2-benzo[a]carbazol-11-yl-5-[6-(3-naphthalen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[6-(3-triphenylen-2-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole?

2-benzo[a]carbazol-11-yl-5-[6-(3-naphthalen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[6-(3-triphenylen-2-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole has a molecular weight of 1726.07 g/mol, XLogP of 33.85, 8 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 2-benzo[a]carbazol-11-yl-5-[6-(3-naphthalen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[6-(3-triphenylen-2-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole is sourced from PubChem (CID 159658375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).