N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-1-amine;N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-2-amine

C136H88N8 — CID 159313208

About N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-1-amine;N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-2-amine

N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-1-amine;N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-2-amine (PubChem CID 159313208) has the molecular formula C136H88N8 and a molecular weight of 1834.26 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-1-amine;N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-2-amine.

Molecular Properties

• Compound Name: N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-1-amine;N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-2-amine
• PubChem CID: 159313208
• Molecular Formula: C136H88N8
• Molecular Weight: 1834.26 g/mol
• Exact Mass: 1832.71
• IUPAC Name: N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-1-amine;N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-2-amine
• SMILES: c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc3c(-c4ccc(-c5ccc6cnccc6c5)cc4)c4ccccc4c(-c4ccc(-c5ccc6cnccc6c5)cc4)c3c2)cc1.c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2cccc3c(-c4ccc(-c5ccc6cnccc6c5)cc4)c4ccccc4c(-c4ccc(-c5ccc6cnccc6c5)cc4)c23)cc1
• InChI: InChI=1S/2C68H44N4/c1-2-11-55(12-3-1)71(56-33-35-57(36-34-56)72-63-18-8-6-13-58(63)59-14-7-9-19-64(59)72)65-20-10-17-62-66(47-25-21-45(22-26-47)49-29-31-53-43-69-39-37-51(53)41-49)60-15-4-5-16-61(60)67(68(62)65)48-27-23-46(24-28-48)50-30-32-54-44-70-40-38-52(54)42-50;1-2-10-55(11-3-1)71(56-30-32-57(33-31-56)72-65-16-8-6-12-59(65)60-13-7-9-17-66(60)72)58-34-35-63-64(42-58)68(48-24-20-46(21-25-48)50-27-29-54-44-70-39-37-52(54)41-50)62-15-5-4-14-61(62)67(63)47-22-18-45(19-23-47)49-26-28-53-43-69-38-36-51(53)40-49/h2*1-44H
• InChIKey: LCURLTBXDDIKCH-UHFFFAOYSA-N
• XLogP: 36.65
• TPSA: 67.90 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 16
• Heavy Atoms: 144
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1834.26
LogP ≤ 5	36.65
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-1-amine;N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-2-amine?

The IUPAC name of N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-1-amine;N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-2-amine (CID 159313208) is N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-1-amine;N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-2-amine.

What is the SMILES notation for N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-1-amine;N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-2-amine?

The canonical SMILES for N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-1-amine;N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-2-amine is c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc3c(-c4ccc(-c5ccc6cnccc6c5)cc4)c4ccccc4c(-c4ccc(-c5ccc6cnccc6c5)cc4)c3c2)cc1.c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2cccc3c(-c4ccc(-c5ccc6cnccc6c5)cc4)c4ccccc4c(-c4ccc(-c5ccc6cnccc6c5)cc4)c23)cc1.

What is the InChIKey of N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-1-amine;N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-2-amine?

The InChIKey is LCURLTBXDDIKCH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C68H44N4/c1-2-11-55(12-3-1)71(56-33-35-57(36-34-56)72-63-18-8-6-13-58(63)59-14-7-9-19-64(59)72)65-20-10-17-62-66(47-25-21-45(22-26-47)49-29-31-53-43-69-39-37-51(53)41-49)60-15-4-5-16-61(60)67(68(62)65)48-27-23-46(24-28-48)50-30-32-54-44-70-40-38-52(54)42-50;1-2-10-55(11-3-1)71(56-30-32-57(33-31-56)72-65-16-8-6-12-59(65)60-13-7-9-17-66(60)72)58-34-35-63-64(42-58)68(48-24-20-46(21-25-48)50-27-29-54-44-70-39-37-52(54)41-50)62-15-5-4-14-61(62)67(63)47-22-18-45(19-23-47)49-26-28-53-43-69-38-36-51(53)40-49/h2*1-44H.

What are the key properties of N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-1-amine;N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-2-amine?

N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-1-amine;N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-2-amine has a molecular weight of 1834.26 g/mol, XLogP of 36.65, 16 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-1-amine;N-(4-carbazol-9-ylphenyl)-9,10-bis(4-isoquinolin-6-ylphenyl)-N-phenylanthracen-2-amine is sourced from PubChem (CID 159313208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).