N-phenanthren-2-yl-N-(3-phenylphenyl)phenanthridin-6-amine;6-[9-phenyl-6-(9-phenylcarbazol-2-yl)carbazol-3-yl]phenanthridine;6-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenanthridine

C137H88N8 — CID 160959265

About N-phenanthren-2-yl-N-(3-phenylphenyl)phenanthridin-6-amine;6-[9-phenyl-6-(9-phenylcarbazol-2-yl)carbazol-3-yl]phenanthridine;6-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenanthridine

N-phenanthren-2-yl-N-(3-phenylphenyl)phenanthridin-6-amine;6-[9-phenyl-6-(9-phenylcarbazol-2-yl)carbazol-3-yl]phenanthridine;6-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenanthridine (PubChem CID 160959265) has the molecular formula C137H88N8 and a molecular weight of 1846.27 g/mol. Its IUPAC name is N-phenanthren-2-yl-N-(3-phenylphenyl)phenanthridin-6-amine;6-[9-phenyl-6-(9-phenylcarbazol-2-yl)carbazol-3-yl]phenanthridine;6-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenanthridine.

Molecular Properties

• Compound Name: N-phenanthren-2-yl-N-(3-phenylphenyl)phenanthridin-6-amine;6-[9-phenyl-6-(9-phenylcarbazol-2-yl)carbazol-3-yl]phenanthridine;6-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenanthridine
• PubChem CID: 160959265
• Molecular Formula: C137H88N8
• Molecular Weight: 1846.27 g/mol
• Exact Mass: 1844.71
• IUPAC Name: N-phenanthren-2-yl-N-(3-phenylphenyl)phenanthridin-6-amine;6-[9-phenyl-6-(9-phenylcarbazol-2-yl)carbazol-3-yl]phenanthridine;6-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenanthridine
• SMILES: c1ccc(-c2cccc(N(c3ccc4c(ccc5ccccc54)c3)c3nc4ccccc4c4ccccc34)c2)cc1.c1ccc(-n2c3ccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)cc3c3cc(-c4nc5ccccc5c5ccccc45)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccc(-c6nc7ccccc7c7ccccc67)cc4n5-c4ccccc4)ccc32)cc1
• InChI: InChI=1S/2C49H31N3.C39H26N2/c1-3-13-35(14-4-1)51-45-22-12-10-19-39(45)42-29-32(24-27-46(42)51)33-25-28-47-43(30-33)40-26-23-34(31-48(40)52(47)36-15-5-2-6-16-36)49-41-20-8-7-17-37(41)38-18-9-11-21-44(38)50-49;1-3-13-35(14-4-1)51-46-27-24-32(33-23-26-40-39-19-10-12-22-45(39)52(48(40)31-33)36-15-5-2-6-16-36)29-42(46)43-30-34(25-28-47(43)51)49-41-20-8-7-17-37(41)38-18-9-11-21-44(38)50-49;1-2-11-27(12-3-1)29-14-10-15-31(25-29)41(32-23-24-34-30(26-32)22-21-28-13-4-5-16-33(28)34)39-37-19-7-6-17-35(37)36-18-8-9-20-38(36)40-39/h2*1-31H;1-26H
• InChIKey: SWUMVIBDNTYWNI-UHFFFAOYSA-N
• XLogP: 36.66
• TPSA: 61.63 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 12
• Heavy Atoms: 145
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1846.27
LogP ≤ 5	36.66
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 N-phenanthren-2-yl-N-(3-phenylphenyl)phenanthridin-6-amine;6-[9-phenyl-6-(9-phenylcarbazol-2-yl)carbazol-3-yl]phenanthridine;6-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenanthridine?

The IUPAC name of N-phenanthren-2-yl-N-(3-phenylphenyl)phenanthridin-6-amine;6-[9-phenyl-6-(9-phenylcarbazol-2-yl)carbazol-3-yl]phenanthridine;6-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenanthridine (CID 160959265) is N-phenanthren-2-yl-N-(3-phenylphenyl)phenanthridin-6-amine;6-[9-phenyl-6-(9-phenylcarbazol-2-yl)carbazol-3-yl]phenanthridine;6-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenanthridine.

What is the SMILES notation for N-phenanthren-2-yl-N-(3-phenylphenyl)phenanthridin-6-amine;6-[9-phenyl-6-(9-phenylcarbazol-2-yl)carbazol-3-yl]phenanthridine;6-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenanthridine?

The canonical SMILES for N-phenanthren-2-yl-N-(3-phenylphenyl)phenanthridin-6-amine;6-[9-phenyl-6-(9-phenylcarbazol-2-yl)carbazol-3-yl]phenanthridine;6-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenanthridine is c1ccc(-c2cccc(N(c3ccc4c(ccc5ccccc54)c3)c3nc4ccccc4c4ccccc34)c2)cc1.c1ccc(-n2c3ccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)cc3c3cc(-c4nc5ccccc5c5ccccc45)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccc(-c6nc7ccccc7c7ccccc67)cc4n5-c4ccccc4)ccc32)cc1.

What is the InChIKey of N-phenanthren-2-yl-N-(3-phenylphenyl)phenanthridin-6-amine;6-[9-phenyl-6-(9-phenylcarbazol-2-yl)carbazol-3-yl]phenanthridine;6-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenanthridine?

The InChIKey is SWUMVIBDNTYWNI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C49H31N3.C39H26N2/c1-3-13-35(14-4-1)51-45-22-12-10-19-39(45)42-29-32(24-27-46(42)51)33-25-28-47-43(30-33)40-26-23-34(31-48(40)52(47)36-15-5-2-6-16-36)49-41-20-8-7-17-37(41)38-18-9-11-21-44(38)50-49;1-3-13-35(14-4-1)51-46-27-24-32(33-23-26-40-39-19-10-12-22-45(39)52(48(40)31-33)36-15-5-2-6-16-36)29-42(46)43-30-34(25-28-47(43)51)49-41-20-8-7-17-37(41)38-18-9-11-21-44(38)50-49;1-2-11-27(12-3-1)29-14-10-15-31(25-29)41(32-23-24-34-30(26-32)22-21-28-13-4-5-16-33(28)34)39-37-19-7-6-17-35(37)36-18-8-9-20-38(36)40-39/h2*1-31H;1-26H.

What are the key properties of N-phenanthren-2-yl-N-(3-phenylphenyl)phenanthridin-6-amine;6-[9-phenyl-6-(9-phenylcarbazol-2-yl)carbazol-3-yl]phenanthridine;6-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenanthridine?

N-phenanthren-2-yl-N-(3-phenylphenyl)phenanthridin-6-amine;6-[9-phenyl-6-(9-phenylcarbazol-2-yl)carbazol-3-yl]phenanthridine;6-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenanthridine has a molecular weight of 1846.27 g/mol, XLogP of 36.66, 12 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-phenanthren-2-yl-N-(3-phenylphenyl)phenanthridin-6-amine;6-[9-phenyl-6-(9-phenylcarbazol-2-yl)carbazol-3-yl]phenanthridine;6-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenanthridine is sourced from PubChem (CID 160959265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).