9-(3-dibenzofuran-4-ylphenyl)-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(9,9-diphenylfluoren-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(1,5-naphthyridin-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzothiazole;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-phenyl-5-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3,4-oxadiazole;14-phenyl-9-(3-quinolin-6-ylphenyl)-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene

C366H227N23O3S — CID 159334340

About 9-(3-dibenzofuran-4-ylphenyl)-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(9,9-diphenylfluoren-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(1,5-naphthyridin-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzothiazole;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-phenyl-5-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3,4-oxadiazole;14-phenyl-9-(3-quinolin-6-ylphenyl)-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene

9-(3-dibenzofuran-4-ylphenyl)-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(9,9-diphenylfluoren-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(1,5-naphthyridin-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzothiazole;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-phenyl-5-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3,4-oxadiazole;14-phenyl-9-(3-quinolin-6-ylphenyl)-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene (PubChem CID 159334340) has the molecular formula C366H227N23O3S and a molecular weight of 5027.07 g/mol. Its IUPAC name is 9-(3-dibenzofuran-4-ylphenyl)-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(9,9-diphenylfluoren-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(1,5-naphthyridin-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzothiazole;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-phenyl-5-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3,4-oxadiazole;14-phenyl-9-(3-quinolin-6-ylphenyl)-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene.

Molecular Properties

• Compound Name: 9-(3-dibenzofuran-4-ylphenyl)-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(9,9-diphenylfluoren-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(1,5-naphthyridin-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzothiazole;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-phenyl-5-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3,4-oxadiazole;14-phenyl-9-(3-quinolin-6-ylphenyl)-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene
• PubChem CID: 159334340
• Molecular Formula: C366H227N23O3S
• Molecular Weight: 5027.07 g/mol
• Exact Mass: 5022.80
• IUPAC Name: 9-(3-dibenzofuran-4-ylphenyl)-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(9,9-diphenylfluoren-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(1,5-naphthyridin-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzothiazole;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-phenyl-5-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3,4-oxadiazole;14-phenyl-9-(3-quinolin-6-ylphenyl)-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene
• SMILES: c1ccc(-c2nc3ccccc3c3c2ccc2c3c3ccccc3n2-c2cccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)c2)cc1.c1ccc(-c2nc3ccccc3c3c2ccc2c3c3ccccc3n2-c2cccc(-c3ccc(-c4nc5ccccc5o4)cc3)c2)cc1.c1ccc(-c2nc3ccccc3c3c2ccc2c3c3ccccc3n2-c2cccc(-c3ccc(-c4nc5ccccc5s4)cc3)c2)cc1.c1ccc(-c2nc3ccccc3c3c2ccc2c3c3ccccc3n2-c2cccc(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c2)cc1.c1ccc(-c2nc3ccccc3c3c2ccc2c3c3ccccc3n2-c2cccc(-c3ccc4ncccc4c3)c2)cc1.c1ccc(-c2nc3ccccc3c3c2ccc2c3c3ccccc3n2-c2cccc(-c3ccc4ncccc4n3)c2)cc1.c1ccc(-c2nc3ccccc3c3c2ccc2c3c3ccccc3n2-c2cccc(-c3cccc4c3oc3ccccc34)c2)cc1.c1ccc(-c2nnc(-c3ccc(-c4cccc(-n5c6ccccc6c6c7c(ccc65)c(-c5ccccc5)nc5ccccc57)c4)cc3)o2)cc1
• InChI: InChI=1S/C56H36N2.C55H34N2.C45H28N4O.C44H27N3O.C44H27N3S.C43H26N2O.C40H25N3.C39H24N4/c1-4-17-37(18-5-1)55-47-33-34-52-54(53(47)45-26-11-14-29-50(45)57-55)46-27-12-15-30-51(46)58(52)42-24-16-19-38(35-42)39-31-32-44-43-25-10-13-28-48(43)56(49(44)36-39,40-20-6-2-7-21-40)41-22-8-3-9-23-41;1-2-16-36(17-3-1)55-47-31-32-50-54(53(47)45-25-10-12-27-48(45)56-55)46-26-11-13-28-49(46)57(50)40-20-14-19-38(34-40)51-41-21-6-8-23-43(41)52(44-24-9-7-22-42(44)51)39-30-29-35-15-4-5-18-37(35)33-39;1-3-12-30(13-4-1)43-37-26-27-40-42(41(37)35-18-7-9-20-38(35)46-43)36-19-8-10-21-39(36)49(40)34-17-11-16-33(28-34)29-22-24-32(25-23-29)45-48-47-44(50-45)31-14-5-2-6-15-31;2*1-2-11-29(12-3-1)43-35-25-26-39-42(41(35)33-15-4-6-17-36(33)45-43)34-16-5-8-19-38(34)47(39)32-14-10-13-31(27-32)28-21-23-30(24-22-28)44-46-37-18-7-9-20-40(37)48-44;1-2-12-27(13-3-1)42-35-24-25-38-41(40(35)33-17-4-7-21-36(33)44-42)34-18-5-8-22-37(34)45(38)29-15-10-14-28(26-29)30-19-11-20-32-31-16-6-9-23-39(31)46-43(30)32;1-2-10-26(11-3-1)40-33-20-22-37-39(38(33)31-15-4-6-17-35(31)42-40)32-16-5-7-18-36(32)43(37)30-14-8-12-27(25-30)28-19-21-34-29(24-28)13-9-23-41-34;1-2-10-25(11-3-1)39-30-19-22-36-38(37(30)28-14-4-6-16-32(28)42-39)29-15-5-7-18-35(29)43(36)27-13-8-12-26(24-27)31-20-21-33-34(41-31)17-9-23-40-33/h1-36H;1-34H;1-28H;2*1-27H;1-26H;1-25H;1-24H
• InChIKey: LFIMOUBKOAMQMT-UHFFFAOYSA-N
• XLogP: 96.24
• TPSA: 272.21 Ų
• H-Bond Acceptors: 27
• Rotatable Bonds: 31
• Heavy Atoms: 393
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5027.07
LogP ≤ 5	96.24
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

What is the IUPAC name of 9-(3-dibenzofuran-4-ylphenyl)-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(9,9-diphenylfluoren-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(1,5-naphthyridin-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzothiazole;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-phenyl-5-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3,4-oxadiazole;14-phenyl-9-(3-quinolin-6-ylphenyl)-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene?

The IUPAC name of 9-(3-dibenzofuran-4-ylphenyl)-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(9,9-diphenylfluoren-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(1,5-naphthyridin-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzothiazole;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-phenyl-5-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3,4-oxadiazole;14-phenyl-9-(3-quinolin-6-ylphenyl)-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene (CID 159334340) is 9-(3-dibenzofuran-4-ylphenyl)-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(9,9-diphenylfluoren-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(1,5-naphthyridin-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzothiazole;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-phenyl-5-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3,4-oxadiazole;14-phenyl-9-(3-quinolin-6-ylphenyl)-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene.

What is the SMILES notation for 9-(3-dibenzofuran-4-ylphenyl)-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(9,9-diphenylfluoren-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(1,5-naphthyridin-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzothiazole;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-phenyl-5-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3,4-oxadiazole;14-phenyl-9-(3-quinolin-6-ylphenyl)-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene?

The canonical SMILES for 9-(3-dibenzofuran-4-ylphenyl)-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(9,9-diphenylfluoren-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(1,5-naphthyridin-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzothiazole;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-phenyl-5-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3,4-oxadiazole;14-phenyl-9-(3-quinolin-6-ylphenyl)-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene is c1ccc(-c2nc3ccccc3c3c2ccc2c3c3ccccc3n2-c2cccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)c2)cc1.c1ccc(-c2nc3ccccc3c3c2ccc2c3c3ccccc3n2-c2cccc(-c3ccc(-c4nc5ccccc5o4)cc3)c2)cc1.c1ccc(-c2nc3ccccc3c3c2ccc2c3c3ccccc3n2-c2cccc(-c3ccc(-c4nc5ccccc5s4)cc3)c2)cc1.c1ccc(-c2nc3ccccc3c3c2ccc2c3c3ccccc3n2-c2cccc(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c2)cc1.c1ccc(-c2nc3ccccc3c3c2ccc2c3c3ccccc3n2-c2cccc(-c3ccc4ncccc4c3)c2)cc1.c1ccc(-c2nc3ccccc3c3c2ccc2c3c3ccccc3n2-c2cccc(-c3ccc4ncccc4n3)c2)cc1.c1ccc(-c2nc3ccccc3c3c2ccc2c3c3ccccc3n2-c2cccc(-c3cccc4c3oc3ccccc34)c2)cc1.c1ccc(-c2nnc(-c3ccc(-c4cccc(-n5c6ccccc6c6c7c(ccc65)c(-c5ccccc5)nc5ccccc57)c4)cc3)o2)cc1.

What is the InChIKey of 9-(3-dibenzofuran-4-ylphenyl)-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(9,9-diphenylfluoren-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(1,5-naphthyridin-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzothiazole;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-phenyl-5-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3,4-oxadiazole;14-phenyl-9-(3-quinolin-6-ylphenyl)-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene?

The InChIKey is LFIMOUBKOAMQMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H36N2.C55H34N2.C45H28N4O.C44H27N3O.C44H27N3S.C43H26N2O.C40H25N3.C39H24N4/c1-4-17-37(18-5-1)55-47-33-34-52-54(53(47)45-26-11-14-29-50(45)57-55)46-27-12-15-30-51(46)58(52)42-24-16-19-38(35-42)39-31-32-44-43-25-10-13-28-48(43)56(49(44)36-39,40-20-6-2-7-21-40)41-22-8-3-9-23-41;1-2-16-36(17-3-1)55-47-31-32-50-54(53(47)45-25-10-12-27-48(45)56-55)46-26-11-13-28-49(46)57(50)40-20-14-19-38(34-40)51-41-21-6-8-23-43(41)52(44-24-9-7-22-42(44)51)39-30-29-35-15-4-5-18-37(35)33-39;1-3-12-30(13-4-1)43-37-26-27-40-42(41(37)35-18-7-9-20-38(35)46-43)36-19-8-10-21-39(36)49(40)34-17-11-16-33(28-34)29-22-24-32(25-23-29)45-48-47-44(50-45)31-14-5-2-6-15-31;2*1-2-11-29(12-3-1)43-35-25-26-39-42(41(35)33-15-4-6-17-36(33)45-43)34-16-5-8-19-38(34)47(39)32-14-10-13-31(27-32)28-21-23-30(24-22-28)44-46-37-18-7-9-20-40(37)48-44;1-2-12-27(13-3-1)42-35-24-25-38-41(40(35)33-17-4-7-21-36(33)44-42)34-18-5-8-22-37(34)45(38)29-15-10-14-28(26-29)30-19-11-20-32-31-16-6-9-23-39(31)46-43(30)32;1-2-10-26(11-3-1)40-33-20-22-37-39(38(33)31-15-4-6-17-35(31)42-40)32-16-5-7-18-36(32)43(37)30-14-8-12-27(25-30)28-19-21-34-29(24-28)13-9-23-41-34;1-2-10-25(11-3-1)39-30-19-22-36-38(37(30)28-14-4-6-16-32(28)42-39)29-15-5-7-18-35(29)43(36)27-13-8-12-26(24-27)31-20-21-33-34(41-31)17-9-23-40-33/h1-36H;1-34H;1-28H;2*1-27H;1-26H;1-25H;1-24H.

What are the key properties of 9-(3-dibenzofuran-4-ylphenyl)-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(9,9-diphenylfluoren-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(1,5-naphthyridin-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzothiazole;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-phenyl-5-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3,4-oxadiazole;14-phenyl-9-(3-quinolin-6-ylphenyl)-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene?

9-(3-dibenzofuran-4-ylphenyl)-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(9,9-diphenylfluoren-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(1,5-naphthyridin-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzothiazole;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-phenyl-5-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3,4-oxadiazole;14-phenyl-9-(3-quinolin-6-ylphenyl)-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene has a molecular weight of 5027.07 g/mol, XLogP of 96.24, 31 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(3-dibenzofuran-4-ylphenyl)-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(9,9-diphenylfluoren-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;9-[3-(1,5-naphthyridin-2-yl)phenyl]-14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzothiazole;2-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-phenyl-5-[4-[3-(14-phenyl-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaen-9-yl)phenyl]phenyl]-1,3,4-oxadiazole;14-phenyl-9-(3-quinolin-6-ylphenyl)-9,15-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene is sourced from PubChem (CID 159334340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).