3-[4-(3,5-dinaphthalen-1-ylphenyl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]naphthalen-1-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[7-(3,5-diphenylphenyl)-9,9-diphenylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-3-[2,3,5,6-tetradeuterio-4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene

C235H150N4 — CID 158219166

About 3-[4-(3,5-dinaphthalen-1-ylphenyl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]naphthalen-1-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[7-(3,5-diphenylphenyl)-9,9-diphenylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-3-[2,3,5,6-tetradeuterio-4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene

3-[4-(3,5-dinaphthalen-1-ylphenyl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]naphthalen-1-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[7-(3,5-diphenylphenyl)-9,9-diphenylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-3-[2,3,5,6-tetradeuterio-4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene (PubChem CID 158219166) has the molecular formula C235H150N4 and a molecular weight of 3033.84 g/mol. Its IUPAC name is 3-[4-(3,5-dinaphthalen-1-ylphenyl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]naphthalen-1-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[7-(3,5-diphenylphenyl)-9,9-diphenylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-3-[2,3,5,6-tetradeuterio-4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene.

Molecular Properties

• Compound Name: 3-[4-(3,5-dinaphthalen-1-ylphenyl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]naphthalen-1-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[7-(3,5-diphenylphenyl)-9,9-diphenylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-3-[2,3,5,6-tetradeuterio-4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene
• PubChem CID: 158219166
• Molecular Formula: C235H150N4
• Molecular Weight: 3033.84 g/mol
• Exact Mass: 3031.21
• IUPAC Name: 3-[4-(3,5-dinaphthalen-1-ylphenyl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]naphthalen-1-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[7-(3,5-diphenylphenyl)-9,9-diphenylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-3-[2,3,5,6-tetradeuterio-4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene
• SMILES: [2H]c1c([2H])c(-c2c3ccccc3c(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3ccccc23)c([2H])c([2H])c1-c1cc2ccc3cccc4c3c2c(c1)n4-c1ccccc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3c4ccccc4c(-c4ccc(-c5cc6ccc7cccc8c7c6c(c5)n8-c5ccccc5)c5ccccc45)c4ccccc34)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3cc(-c5cc6ccc7cccc8c7c6c(c5)n8-c5ccccc5)ccc3-4)c2)cc1.c1ccc(-n2c3cccc4ccc5cc(-c6ccc(-c7cc(-c8cccc9ccccc89)cc(-c8cccc9ccccc89)c7)cc6)cc2c5c43)cc1
• InChI: InChI=1S/C63H41N.C62H39N.C58H37N.C52H33N/c1-6-17-42(18-7-1)48-36-49(43-19-8-2-9-20-43)38-50(37-48)45-31-33-55-56-34-32-46(40-58(56)63(57(55)39-45,52-22-10-3-11-23-52)53-24-12-4-13-25-53)51-35-47-30-29-44-21-16-28-59-61(44)62(47)60(41-51)64(59)54-26-14-5-15-27-54;1-4-17-40(18-5-1)44-36-45(41-19-6-2-7-20-41)38-47(37-44)59-52-26-12-14-28-54(52)62(55-29-15-13-27-53(55)59)56-34-33-49(50-24-10-11-25-51(50)56)46-35-43-32-31-42-21-16-30-57-60(42)61(43)58(39-46)63(57)48-22-8-3-9-23-48;1-4-15-38(16-5-1)44-34-45(39-17-6-2-7-18-39)36-47(35-44)56-51-24-12-10-22-49(51)55(50-23-11-13-25-52(50)56)42-29-27-40(28-30-42)46-33-43-32-31-41-19-14-26-53-57(41)58(43)54(37-46)59(53)48-20-8-3-9-21-48;1-2-16-44(17-3-1)53-49-22-10-15-38-27-28-39-29-41(33-50(53)52(39)51(38)49)35-25-23-34(24-26-35)40-30-42(47-20-8-13-36-11-4-6-18-45(36)47)32-43(31-40)48-21-9-14-37-12-5-7-19-46(37)48/h1-41H;1-39H;1-37H;1-33H/i;;27D,28D,29D,30D
• InChIKey: GDALQWVNADKOPK-POGBPHALSA-N
• XLogP: 63.94
• TPSA: 19.72 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 24
• Heavy Atoms: 239
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	3033.84
LogP ≤ 5	63.94
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'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 3-[4-(3,5-dinaphthalen-1-ylphenyl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]naphthalen-1-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[7-(3,5-diphenylphenyl)-9,9-diphenylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-3-[2,3,5,6-tetradeuterio-4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene?

The IUPAC name of 3-[4-(3,5-dinaphthalen-1-ylphenyl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]naphthalen-1-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[7-(3,5-diphenylphenyl)-9,9-diphenylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-3-[2,3,5,6-tetradeuterio-4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene (CID 158219166) is 3-[4-(3,5-dinaphthalen-1-ylphenyl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]naphthalen-1-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[7-(3,5-diphenylphenyl)-9,9-diphenylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-3-[2,3,5,6-tetradeuterio-4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene.

What is the SMILES notation for 3-[4-(3,5-dinaphthalen-1-ylphenyl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]naphthalen-1-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[7-(3,5-diphenylphenyl)-9,9-diphenylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-3-[2,3,5,6-tetradeuterio-4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene?

The canonical SMILES for 3-[4-(3,5-dinaphthalen-1-ylphenyl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]naphthalen-1-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[7-(3,5-diphenylphenyl)-9,9-diphenylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-3-[2,3,5,6-tetradeuterio-4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene is [2H]c1c([2H])c(-c2c3ccccc3c(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3ccccc23)c([2H])c([2H])c1-c1cc2ccc3cccc4c3c2c(c1)n4-c1ccccc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3c4ccccc4c(-c4ccc(-c5cc6ccc7cccc8c7c6c(c5)n8-c5ccccc5)c5ccccc45)c4ccccc34)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3cc(-c5cc6ccc7cccc8c7c6c(c5)n8-c5ccccc5)ccc3-4)c2)cc1.c1ccc(-n2c3cccc4ccc5cc(-c6ccc(-c7cc(-c8cccc9ccccc89)cc(-c8cccc9ccccc89)c7)cc6)cc2c5c43)cc1.

What is the InChIKey of 3-[4-(3,5-dinaphthalen-1-ylphenyl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]naphthalen-1-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[7-(3,5-diphenylphenyl)-9,9-diphenylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-3-[2,3,5,6-tetradeuterio-4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene?

The InChIKey is GDALQWVNADKOPK-POGBPHALSA-N. The full InChI is InChI=1S/C63H41N.C62H39N.C58H37N.C52H33N/c1-6-17-42(18-7-1)48-36-49(43-19-8-2-9-20-43)38-50(37-48)45-31-33-55-56-34-32-46(40-58(56)63(57(55)39-45,52-22-10-3-11-23-52)53-24-12-4-13-25-53)51-35-47-30-29-44-21-16-28-59-61(44)62(47)60(41-51)64(59)54-26-14-5-15-27-54;1-4-17-40(18-5-1)44-36-45(41-19-6-2-7-20-41)38-47(37-44)59-52-26-12-14-28-54(52)62(55-29-15-13-27-53(55)59)56-34-33-49(50-24-10-11-25-51(50)56)46-35-43-32-31-42-21-16-30-57-60(42)61(43)58(39-46)63(57)48-22-8-3-9-23-48;1-4-15-38(16-5-1)44-34-45(39-17-6-2-7-18-39)36-47(35-44)56-51-24-12-10-22-49(51)55(50-23-11-13-25-52(50)56)42-29-27-40(28-30-42)46-33-43-32-31-41-19-14-26-53-57(41)58(43)54(37-46)59(53)48-20-8-3-9-21-48;1-2-16-44(17-3-1)53-49-22-10-15-38-27-28-39-29-41(33-50(53)52(39)51(38)49)35-25-23-34(24-26-35)40-30-42(47-20-8-13-36-11-4-6-18-45(36)47)32-43(31-40)48-21-9-14-37-12-5-7-19-46(37)48/h1-41H;1-39H;1-37H;1-33H/i;;27D,28D,29D,30D;.

What are the key properties of 3-[4-(3,5-dinaphthalen-1-ylphenyl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]naphthalen-1-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[7-(3,5-diphenylphenyl)-9,9-diphenylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-3-[2,3,5,6-tetradeuterio-4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene?

3-[4-(3,5-dinaphthalen-1-ylphenyl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]naphthalen-1-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[7-(3,5-diphenylphenyl)-9,9-diphenylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-3-[2,3,5,6-tetradeuterio-4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene has a molecular weight of 3033.84 g/mol, XLogP of 63.94, 24 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[4-(3,5-dinaphthalen-1-ylphenyl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]naphthalen-1-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;3-[7-(3,5-diphenylphenyl)-9,9-diphenylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-3-[2,3,5,6-tetradeuterio-4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene is sourced from PubChem (CID 158219166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).