15-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-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-(10-phenanthren-9-ylanthracen-9-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-(3-phenylphenyl)anthracen-9-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;8-phenyl-15-[10-(4-phenylphenyl)anthracen-9-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

C185H120N8O4P4 — CID 159350190

About 15-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-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-(10-phenanthren-9-ylanthracen-9-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-(3-phenylphenyl)anthracen-9-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;8-phenyl-15-[10-(4-phenylphenyl)anthracen-9-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-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-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-(10-phenanthren-9-ylanthracen-9-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-(3-phenylphenyl)anthracen-9-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;8-phenyl-15-[10-(4-phenylphenyl)anthracen-9-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 159350190) has the molecular formula C185H120N8O4P4 and a molecular weight of 2642.94 g/mol. Its IUPAC name is 15-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-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-(10-phenanthren-9-ylanthracen-9-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-(3-phenylphenyl)anthracen-9-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;8-phenyl-15-[10-(4-phenylphenyl)anthracen-9-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-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-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-(10-phenanthren-9-ylanthracen-9-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-(3-phenylphenyl)anthracen-9-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;8-phenyl-15-[10-(4-phenylphenyl)anthracen-9-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: 159350190
• Molecular Formula: C185H120N8O4P4
• Molecular Weight: 2642.94 g/mol
• Exact Mass: 2640.84
• IUPAC Name: 15-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-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-(10-phenanthren-9-ylanthracen-9-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-(3-phenylphenyl)anthracen-9-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;8-phenyl-15-[10-(4-phenylphenyl)anthracen-9-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: CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4nc5cccc6c5n4-c4ccccc4P6(=O)c4ccccc4)c4ccccc34)cc21.O=P1(c2ccccc2)c2ccccc2-n2c(-c3c4ccccc4c(-c4cc5ccccc5c5ccccc45)c4ccccc34)nc3cccc1c32.O=P1(c2ccccc2)c2ccccc2-n2c(-c3c4ccccc4c(-c4ccc(-c5ccccc5)cc4)c4ccccc34)nc3cccc1c32.O=P1(c2ccccc2)c2ccccc2-n2c(-c3c4ccccc4c(-c4cccc(-c5ccccc5)c4)c4ccccc34)nc3cccc1c32
• InChI: InChI=1S/C48H33N2OP.C47H29N2OP.2C45H29N2OP/c1-48(2)38-22-11-10-17-32(38)33-28-27-30(29-39(33)48)44-34-18-6-8-20-36(34)45(37-21-9-7-19-35(37)44)47-49-40-23-14-26-43-46(40)50(47)41-24-12-13-25-42(41)52(43,51)31-15-4-3-5-16-31;50-51(31-16-2-1-3-17-31)42-27-13-12-26-41(42)49-46-40(25-14-28-43(46)51)48-47(49)45-37-23-10-8-21-35(37)44(36-22-9-11-24-38(36)45)39-29-30-15-4-5-18-32(30)33-19-6-7-20-34(33)39;48-49(33-19-5-2-6-20-33)40-27-12-11-26-39(40)47-44-38(25-14-28-41(44)49)46-45(47)43-36-23-9-7-21-34(36)42(35-22-8-10-24-37(35)43)32-18-13-17-31(29-32)30-15-3-1-4-16-30;48-49(33-16-5-2-6-17-33)40-24-12-11-23-39(40)47-44-38(22-13-25-41(44)49)46-45(47)43-36-20-9-7-18-34(36)42(35-19-8-10-21-37(35)43)32-28-26-31(27-29-32)30-14-3-1-4-15-30/h3-29H,1-2H3;1-29H;2*1-29H
• InChIKey: LHFMNJJVEQVXTB-UHFFFAOYSA-N
• XLogP: 42.42
• TPSA: 139.56 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 14
• Heavy Atoms: 201
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2642.94
LogP ≤ 5	42.42
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 15-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-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-(10-phenanthren-9-ylanthracen-9-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-(3-phenylphenyl)anthracen-9-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;8-phenyl-15-[10-(4-phenylphenyl)anthracen-9-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-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-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-(10-phenanthren-9-ylanthracen-9-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-(3-phenylphenyl)anthracen-9-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;8-phenyl-15-[10-(4-phenylphenyl)anthracen-9-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 159350190) is 15-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-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-(10-phenanthren-9-ylanthracen-9-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-(3-phenylphenyl)anthracen-9-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;8-phenyl-15-[10-(4-phenylphenyl)anthracen-9-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-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-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-(10-phenanthren-9-ylanthracen-9-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-(3-phenylphenyl)anthracen-9-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;8-phenyl-15-[10-(4-phenylphenyl)anthracen-9-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-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-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-(10-phenanthren-9-ylanthracen-9-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-(3-phenylphenyl)anthracen-9-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;8-phenyl-15-[10-(4-phenylphenyl)anthracen-9-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 CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4nc5cccc6c5n4-c4ccccc4P6(=O)c4ccccc4)c4ccccc34)cc21.O=P1(c2ccccc2)c2ccccc2-n2c(-c3c4ccccc4c(-c4cc5ccccc5c5ccccc45)c4ccccc34)nc3cccc1c32.O=P1(c2ccccc2)c2ccccc2-n2c(-c3c4ccccc4c(-c4ccc(-c5ccccc5)cc4)c4ccccc34)nc3cccc1c32.O=P1(c2ccccc2)c2ccccc2-n2c(-c3c4ccccc4c(-c4cccc(-c5ccccc5)c4)c4ccccc34)nc3cccc1c32.

What is the InChIKey of 15-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-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-(10-phenanthren-9-ylanthracen-9-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-(3-phenylphenyl)anthracen-9-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;8-phenyl-15-[10-(4-phenylphenyl)anthracen-9-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 LHFMNJJVEQVXTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H33N2OP.C47H29N2OP.2C45H29N2OP/c1-48(2)38-22-11-10-17-32(38)33-28-27-30(29-39(33)48)44-34-18-6-8-20-36(34)45(37-21-9-7-19-35(37)44)47-49-40-23-14-26-43-46(40)50(47)41-24-12-13-25-42(41)52(43,51)31-15-4-3-5-16-31;50-51(31-16-2-1-3-17-31)42-27-13-12-26-41(42)49-46-40(25-14-28-43(46)51)48-47(49)45-37-23-10-8-21-35(37)44(36-22-9-11-24-38(36)45)39-29-30-15-4-5-18-32(30)33-19-6-7-20-34(33)39;48-49(33-19-5-2-6-20-33)40-27-12-11-26-39(40)47-44-38(25-14-28-41(44)49)46-45(47)43-36-23-9-7-21-34(36)42(35-22-8-10-24-37(35)43)32-18-13-17-31(29-32)30-15-3-1-4-16-30;48-49(33-16-5-2-6-17-33)40-24-12-11-23-39(40)47-44-38(22-13-25-41(44)49)46-45(47)43-36-20-9-7-18-34(36)42(35-19-8-10-21-37(35)43)32-28-26-31(27-29-32)30-14-3-1-4-15-30/h3-29H,1-2H3;1-29H;2*1-29H.

What are the key properties of 15-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-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-(10-phenanthren-9-ylanthracen-9-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-(3-phenylphenyl)anthracen-9-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;8-phenyl-15-[10-(4-phenylphenyl)anthracen-9-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-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-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-(10-phenanthren-9-ylanthracen-9-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-(3-phenylphenyl)anthracen-9-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;8-phenyl-15-[10-(4-phenylphenyl)anthracen-9-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 2642.94 g/mol, XLogP of 42.42, 14 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 15-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-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-(10-phenanthren-9-ylanthracen-9-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-(3-phenylphenyl)anthracen-9-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;8-phenyl-15-[10-(4-phenylphenyl)anthracen-9-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 159350190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).