15-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;15-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;8-phenyl-15-[10-phenyl-9-(3-phenylphenyl)anthracen-2-yl]-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide

C149H95N6O3P3 — CID 161184732

About 15-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;15-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;8-phenyl-15-[10-phenyl-9-(3-phenylphenyl)anthracen-2-yl]-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide

15-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;15-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;8-phenyl-15-[10-phenyl-9-(3-phenylphenyl)anthracen-2-yl]-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide (PubChem CID 161184732) has the molecular formula C149H95N6O3P3 and a molecular weight of 2110.36 g/mol. Its IUPAC name is 15-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;15-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;8-phenyl-15-[10-phenyl-9-(3-phenylphenyl)anthracen-2-yl]-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide.

Molecular Properties

• Compound Name: 15-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;15-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;8-phenyl-15-[10-phenyl-9-(3-phenylphenyl)anthracen-2-yl]-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide
• PubChem CID: 161184732
• Molecular Formula: C149H95N6O3P3
• Molecular Weight: 2110.36 g/mol
• Exact Mass: 2108.67
• IUPAC Name: 15-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;15-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;8-phenyl-15-[10-phenyl-9-(3-phenylphenyl)anthracen-2-yl]-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide
• SMILES: O=P1(c2ccccc2)c2ccccc2-n2c(-c3ccc4c(-c5ccccc5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)nc3cccc1c32.O=P1(c2ccccc2)c2ccccc2-n2c(-c3ccc4c(-c5ccccc5)c5ccccc5c(-c5cccc(-c6ccccc6)c5)c4c3)nc3cccc1c32.O=P1(c2ccccc2)c2ccccc2-n2c(-c3ccc4c(-c5ccccc5)c5ccccc5c(-c5cccc6ccccc56)c4c3)nc3cccc1c32
• InChI: InChI=1S/C51H33N2OP.2C49H31N2OP/c54-55(39-22-8-3-9-23-39)46-28-13-12-27-45(46)53-50-44(26-15-29-47(50)55)52-51(53)38-30-31-42-43(33-38)49(37-21-14-20-36(32-37)34-16-4-1-5-17-34)41-25-11-10-24-40(41)48(42)35-18-6-2-7-19-35;52-53(35-19-5-2-6-20-35)44-27-12-11-26-43(44)51-48-42(25-14-28-45(48)53)50-49(51)34-29-30-40-41(31-34)47(37-24-13-18-32-15-7-8-21-36(32)37)39-23-10-9-22-38(39)46(40)33-16-3-1-4-17-33;52-53(37-18-5-2-6-19-37)44-24-12-11-23-43(44)51-48-42(22-13-25-45(48)53)50-49(51)36-28-29-40-41(31-36)47(35-27-26-32-14-7-8-17-34(32)30-35)39-21-10-9-20-38(39)46(40)33-15-3-1-4-16-33/h1-33H;2*1-31H
• InChIKey: USXZAOIIWCWBEF-UHFFFAOYSA-N
• XLogP: 34.83
• TPSA: 104.67 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 13
• Heavy Atoms: 161
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2110.36
LogP ≤ 5	34.83
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 15-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;15-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;8-phenyl-15-[10-phenyl-9-(3-phenylphenyl)anthracen-2-yl]-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide?

The IUPAC name of 15-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;15-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;8-phenyl-15-[10-phenyl-9-(3-phenylphenyl)anthracen-2-yl]-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide (CID 161184732) is 15-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;15-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;8-phenyl-15-[10-phenyl-9-(3-phenylphenyl)anthracen-2-yl]-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide.

What is the SMILES notation for 15-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;15-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;8-phenyl-15-[10-phenyl-9-(3-phenylphenyl)anthracen-2-yl]-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide?

The canonical SMILES for 15-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;15-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;8-phenyl-15-[10-phenyl-9-(3-phenylphenyl)anthracen-2-yl]-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide is O=P1(c2ccccc2)c2ccccc2-n2c(-c3ccc4c(-c5ccccc5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)nc3cccc1c32.O=P1(c2ccccc2)c2ccccc2-n2c(-c3ccc4c(-c5ccccc5)c5ccccc5c(-c5cccc(-c6ccccc6)c5)c4c3)nc3cccc1c32.O=P1(c2ccccc2)c2ccccc2-n2c(-c3ccc4c(-c5ccccc5)c5ccccc5c(-c5cccc6ccccc56)c4c3)nc3cccc1c32.

What is the InChIKey of 15-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;15-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;8-phenyl-15-[10-phenyl-9-(3-phenylphenyl)anthracen-2-yl]-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide?

The InChIKey is USXZAOIIWCWBEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H33N2OP.2C49H31N2OP/c54-55(39-22-8-3-9-23-39)46-28-13-12-27-45(46)53-50-44(26-15-29-47(50)55)52-51(53)38-30-31-42-43(33-38)49(37-21-14-20-36(32-37)34-16-4-1-5-17-34)41-25-11-10-24-40(41)48(42)35-18-6-2-7-19-35;52-53(35-19-5-2-6-20-35)44-27-12-11-26-43(44)51-48-42(25-14-28-45(48)53)50-49(51)34-29-30-40-41(31-34)47(37-24-13-18-32-15-7-8-21-36(32)37)39-23-10-9-22-38(39)46(40)33-16-3-1-4-17-33;52-53(37-18-5-2-6-19-37)44-24-12-11-23-43(44)51-48-42(22-13-25-45(48)53)50-49(51)36-28-29-40-41(31-36)47(35-27-26-32-14-7-8-17-34(32)30-35)39-21-10-9-20-38(39)46(40)33-15-3-1-4-16-33/h1-33H;2*1-31H.

What are the key properties of 15-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;15-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;8-phenyl-15-[10-phenyl-9-(3-phenylphenyl)anthracen-2-yl]-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide?

15-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;15-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;8-phenyl-15-[10-phenyl-9-(3-phenylphenyl)anthracen-2-yl]-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide has a molecular weight of 2110.36 g/mol, XLogP of 34.83, 13 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 15-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;15-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)-8-phenyl-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide;8-phenyl-15-[10-phenyl-9-(3-phenylphenyl)anthracen-2-yl]-1,14-diaza-8λ5-phosphatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16),14-heptaene 8-oxide is sourced from PubChem (CID 161184732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).