18-[9,10-bis(4-phenylphenyl)anthracen-2-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-1-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-2-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-diphenylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-1-ylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-phenylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene

C394H242N16 — CID 159468676

About 18-[9,10-bis(4-phenylphenyl)anthracen-2-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-1-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-2-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-diphenylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-1-ylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-phenylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene

18-[9,10-bis(4-phenylphenyl)anthracen-2-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-1-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-2-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-diphenylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-1-ylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-phenylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene (PubChem CID 159468676) has the molecular formula C394H242N16 and a molecular weight of 5200.38 g/mol. Its IUPAC name is 18-[9,10-bis(4-phenylphenyl)anthracen-2-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-1-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-2-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-diphenylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-1-ylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-phenylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene.

Molecular Properties

• Compound Name: 18-[9,10-bis(4-phenylphenyl)anthracen-2-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-1-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-2-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-diphenylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-1-ylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-phenylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene
• PubChem CID: 159468676
• Molecular Formula: C394H242N16
• Molecular Weight: 5200.38 g/mol
• Exact Mass: 5195.94
• IUPAC Name: 18-[9,10-bis(4-phenylphenyl)anthracen-2-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-1-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-2-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-diphenylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-1-ylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-phenylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene
• SMILES: c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4ccc5c(c4)nc4c6ccccc6c6ccccc6n54)ccc23)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5ccccc5)cc4)c4cc(-c5ccc6c(c5)nc5c7ccccc7c7ccccc7n65)ccc34)cc2)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5c(c4)nc4c6ccccc6c6ccccc6n54)c4ccccc34)cc2)cc1.c1ccc(-c2ccc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5c(c4)nc4c6ccccc6c6ccccc6n54)c3c2)cc1.c1ccc2c(-c3c4ccccc4c(-c4ccc5c(c4)nc4c6ccccc6c6ccccc6n54)c4ccccc34)cccc2c1.c1ccc2c(-c3c4ccccc4c(-c4cccc5ccccc45)c4cc(-c5ccc6c(c5)nc5c7ccccc7c7ccccc7n65)ccc34)cccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5ccc6c(c5)nc5c7ccccc7c7ccccc7n65)ccc34)ccc2c1.c1ccc2cc(-c3ccc(-c4c5ccccc5c(-c5ccc6c(c5)nc5c7ccccc7c7ccccc7n65)c5ccccc45)cc3)ccc2c1
• InChI: InChI=1S/C57H36N2.2C53H32N2.2C49H30N2.2C45H28N2.C43H26N2/c1-3-13-37(14-4-1)39-23-27-41(28-24-39)55-47-19-8-9-20-48(47)56(42-29-25-40(26-30-42)38-15-5-2-6-16-38)51-35-43(31-33-49(51)55)44-32-34-54-52(36-44)58-57-50-21-10-7-17-45(50)46-18-11-12-22-53(46)59(54)57;1-3-17-37-33(13-1)15-11-24-41(37)51-43-21-6-7-22-44(43)52(42-25-12-16-34-14-2-4-18-38(34)42)47-31-35(27-29-45(47)51)36-28-30-50-48(32-36)54-53-46-23-8-5-19-39(46)40-20-9-10-26-49(40)55(50)53;1-3-13-35-29-39(23-21-33(35)11-1)51-43-17-6-7-18-44(43)52(40-24-22-34-12-2-4-14-36(34)30-40)47-31-37(25-27-45(47)51)38-26-28-50-48(32-38)54-53-46-19-8-5-15-41(46)42-16-9-10-20-49(42)55(50)53;1-2-12-34-29-35(26-23-31(34)11-1)32-21-24-33(25-22-32)47-39-15-4-6-17-41(39)48(42-18-7-5-16-40(42)47)36-27-28-46-44(30-36)50-49-43-19-8-3-13-37(43)38-14-9-10-20-45(38)51(46)49;1-2-12-31(13-3-1)34-24-26-41-43(29-34)48(40-19-8-7-18-39(40)47(41)35-23-22-32-14-4-5-15-33(32)28-35)36-25-27-46-44(30-36)50-49-42-20-9-6-16-37(42)38-17-10-11-21-45(38)51(46)49;1-3-13-29(14-4-1)43-35-19-8-9-20-36(35)44(30-15-5-2-6-16-30)39-27-31(23-25-37(39)43)32-24-26-42-40(28-32)46-45-38-21-10-7-17-33(38)34-18-11-12-22-41(34)47(42)45;1-2-12-29(13-3-1)30-22-24-31(25-23-30)43-35-16-5-7-18-37(35)44(38-19-8-6-17-36(38)43)32-26-27-42-40(28-32)46-45-39-20-9-4-14-33(39)34-15-10-11-21-41(34)47(42)45;1-2-14-29-27(12-1)13-11-22-32(29)42-35-19-6-4-17-33(35)41(34-18-5-7-20-36(34)42)28-24-25-40-38(26-28)44-43-37-21-8-3-15-30(37)31-16-9-10-23-39(31)45(40)43/h1-36H;2*1-32H;2*1-30H;2*1-28H;1-26H
• InChIKey: LVNAKVIITYEGMX-UHFFFAOYSA-N
• XLogP: 106.55
• TPSA: 138.40 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 25
• Heavy Atoms: 410
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5200.38
LogP ≤ 5	106.55
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of 18-[9,10-bis(4-phenylphenyl)anthracen-2-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-1-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-2-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-diphenylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-1-ylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-phenylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene?

The IUPAC name of 18-[9,10-bis(4-phenylphenyl)anthracen-2-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-1-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-2-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-diphenylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-1-ylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-phenylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene (CID 159468676) is 18-[9,10-bis(4-phenylphenyl)anthracen-2-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-1-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-2-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-diphenylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-1-ylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-phenylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene.

What is the SMILES notation for 18-[9,10-bis(4-phenylphenyl)anthracen-2-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-1-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-2-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-diphenylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-1-ylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-phenylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene?

The canonical SMILES for 18-[9,10-bis(4-phenylphenyl)anthracen-2-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-1-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-2-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-diphenylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-1-ylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-phenylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene is c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4ccc5c(c4)nc4c6ccccc6c6ccccc6n54)ccc23)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5ccccc5)cc4)c4cc(-c5ccc6c(c5)nc5c7ccccc7c7ccccc7n65)ccc34)cc2)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5c(c4)nc4c6ccccc6c6ccccc6n54)c4ccccc34)cc2)cc1.c1ccc(-c2ccc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5c(c4)nc4c6ccccc6c6ccccc6n54)c3c2)cc1.c1ccc2c(-c3c4ccccc4c(-c4ccc5c(c4)nc4c6ccccc6c6ccccc6n54)c4ccccc34)cccc2c1.c1ccc2c(-c3c4ccccc4c(-c4cccc5ccccc45)c4cc(-c5ccc6c(c5)nc5c7ccccc7c7ccccc7n65)ccc34)cccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5ccc6c(c5)nc5c7ccccc7c7ccccc7n65)ccc34)ccc2c1.c1ccc2cc(-c3ccc(-c4c5ccccc5c(-c5ccc6c(c5)nc5c7ccccc7c7ccccc7n65)c5ccccc45)cc3)ccc2c1.

What is the InChIKey of 18-[9,10-bis(4-phenylphenyl)anthracen-2-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-1-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-2-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-diphenylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-1-ylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-phenylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene?

The InChIKey is LVNAKVIITYEGMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H36N2.2C53H32N2.2C49H30N2.2C45H28N2.C43H26N2/c1-3-13-37(14-4-1)39-23-27-41(28-24-39)55-47-19-8-9-20-48(47)56(42-29-25-40(26-30-42)38-15-5-2-6-16-38)51-35-43(31-33-49(51)55)44-32-34-54-52(36-44)58-57-50-21-10-7-17-45(50)46-18-11-12-22-53(46)59(54)57;1-3-17-37-33(13-1)15-11-24-41(37)51-43-21-6-7-22-44(43)52(42-25-12-16-34-14-2-4-18-38(34)42)47-31-35(27-29-45(47)51)36-28-30-50-48(32-36)54-53-46-23-8-5-19-39(46)40-20-9-10-26-49(40)55(50)53;1-3-13-35-29-39(23-21-33(35)11-1)51-43-17-6-7-18-44(43)52(40-24-22-34-12-2-4-14-36(34)30-40)47-31-37(25-27-45(47)51)38-26-28-50-48(32-38)54-53-46-19-8-5-15-41(46)42-16-9-10-20-49(42)55(50)53;1-2-12-34-29-35(26-23-31(34)11-1)32-21-24-33(25-22-32)47-39-15-4-6-17-41(39)48(42-18-7-5-16-40(42)47)36-27-28-46-44(30-36)50-49-43-19-8-3-13-37(43)38-14-9-10-20-45(38)51(46)49;1-2-12-31(13-3-1)34-24-26-41-43(29-34)48(40-19-8-7-18-39(40)47(41)35-23-22-32-14-4-5-15-33(32)28-35)36-25-27-46-44(30-36)50-49-42-20-9-6-16-37(42)38-17-10-11-21-45(38)51(46)49;1-3-13-29(14-4-1)43-35-19-8-9-20-36(35)44(30-15-5-2-6-16-30)39-27-31(23-25-37(39)43)32-24-26-42-40(28-32)46-45-38-21-10-7-17-33(38)34-18-11-12-22-41(34)47(42)45;1-2-12-29(13-3-1)30-22-24-31(25-23-30)43-35-16-5-7-18-37(35)44(38-19-8-6-17-36(38)43)32-26-27-42-40(28-32)46-45-39-20-9-4-14-33(39)34-15-10-11-21-41(34)47(42)45;1-2-14-29-27(12-1)13-11-22-32(29)42-35-19-6-4-17-33(35)41(34-18-5-7-20-36(34)42)28-24-25-40-38(26-28)44-43-37-21-8-3-15-30(37)31-16-9-10-23-39(31)45(40)43/h1-36H;2*1-32H;2*1-30H;2*1-28H;1-26H.

What are the key properties of 18-[9,10-bis(4-phenylphenyl)anthracen-2-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-1-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-2-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-diphenylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-1-ylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-phenylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene?

18-[9,10-bis(4-phenylphenyl)anthracen-2-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-1-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-2-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-diphenylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-1-ylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-phenylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene has a molecular weight of 5200.38 g/mol, XLogP of 106.55, 25 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 18-[9,10-bis(4-phenylphenyl)anthracen-2-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-1-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-dinaphthalen-2-ylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(9,10-diphenylanthracen-2-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-1-ylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene;18-[10-(4-phenylphenyl)anthracen-9-yl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15(20),16,18-decaene is sourced from PubChem (CID 159468676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).