N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-6'-amine

C56H36N4 — CID 162484186

About N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-6'-amine

N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-6'-amine (PubChem CID 162484186) has the molecular formula C56H36N4 and a molecular weight of 764.93 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-6'-amine.

Molecular Properties

• Compound Name: N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-6'-amine
• PubChem CID: 162484186
• Molecular Formula: C56H36N4
• Molecular Weight: 764.93 g/mol
• Exact Mass: 764.29
• IUPAC Name: N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-6'-amine
• SMILES: c1ccc(-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3cccc4nc5n(c34)-c3ccccc3C53c4ccccc4-c4ccccc43)cc2)cc1
• InChI: InChI=1S/C56H36N4/c1-2-15-37(16-3-1)38-29-31-39(32-30-38)58(40-33-35-41(36-34-40)59-50-25-11-6-19-44(50)45-20-7-12-26-51(45)59)53-28-14-24-49-54(53)60-52-27-13-10-23-48(52)56(55(60)57-49)46-21-8-4-17-42(46)43-18-5-9-22-47(43)56/h1-36H
• InChIKey: SJVDJLGVNIRLRZ-UHFFFAOYSA-N
• XLogP: 13.94
• TPSA: 25.99 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 60
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	764.93
LogP ≤ 5	13.94
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-6'-amine?

The IUPAC name of N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-6'-amine (CID 162484186) is N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-6'-amine.

What is the SMILES notation for N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-6'-amine?

The canonical SMILES for N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-6'-amine is c1ccc(-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3cccc4nc5n(c34)-c3ccccc3C53c4ccccc4-c4ccccc43)cc2)cc1.

What is the InChIKey of N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-6'-amine?

The InChIKey is SJVDJLGVNIRLRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H36N4/c1-2-15-37(16-3-1)38-29-31-39(32-30-38)58(40-33-35-41(36-34-40)59-50-25-11-6-19-44(50)45-20-7-12-26-51(45)59)53-28-14-24-49-54(53)60-52-27-13-10-23-48(52)56(55(60)57-49)46-21-8-4-17-42(46)43-18-5-9-22-47(43)56/h1-36H.

What are the key properties of N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-6'-amine?

N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-6'-amine has a molecular weight of 764.93 g/mol, XLogP of 13.94, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,11'-indolo[1,2-a]benzimidazole]-6'-amine is sourced from PubChem (CID 162484186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).