4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline;N-[4-[3-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;N,N-diphenyl-18-[4-(N-phenylanilino)phenyl]-12-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(21),2(11),3,5(10),6,8,13,15,17,19-decaen-7-amine

C324H216N12S — CID 158637517

About 4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline;N-[4-[3-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;N,N-diphenyl-18-[4-(N-phenylanilino)phenyl]-12-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(21),2(11),3,5(10),6,8,13,15,17,19-decaen-7-amine

4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline;N-[4-[3-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;N,N-diphenyl-18-[4-(N-phenylanilino)phenyl]-12-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(21),2(11),3,5(10),6,8,13,15,17,19-decaen-7-amine (PubChem CID 158637517) has the molecular formula C324H216N12S and a molecular weight of 4309.44 g/mol. Its IUPAC name is 4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline;N-[4-[3-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;N,N-diphenyl-18-[4-(N-phenylanilino)phenyl]-12-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(21),2(11),3,5(10),6,8,13,15,17,19-decaen-7-amine.

Molecular Properties

• Compound Name: 4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline;N-[4-[3-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;N,N-diphenyl-18-[4-(N-phenylanilino)phenyl]-12-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(21),2(11),3,5(10),6,8,13,15,17,19-decaen-7-amine
• PubChem CID: 158637517
• Molecular Formula: C324H216N12S
• Molecular Weight: 4309.44 g/mol
• Exact Mass: 4305.70
• IUPAC Name: 4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline;N-[4-[3-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;N,N-diphenyl-18-[4-(N-phenylanilino)phenyl]-12-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(21),2(11),3,5(10),6,8,13,15,17,19-decaen-7-amine
• SMILES: c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N5c6c(ccc7cc(N(c8ccccc8)c8ccccc8)ccc67)-c6ccc(-c7ccc(N(c8ccccc8)c8ccccc8)cc7)c7cccc5c67)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc(N5c6c(ccc7ccccc67)-c6cccc7cccc5c67)c4)cc3)cc2)cc1.c1ccc(N(c2ccc(-c3ccc(N4c5c(ccc6ccccc56)-c5cccc6cccc4c56)cc3)cc2)c2ccc(-c3ccc4sc5ccccc5c4c3)cc2)cc1.c1ccc(N(c2ccc(-c3ccc(N4c5c(ccc6ccccc56)-c5cccc6cccc4c56)cc3)cc2)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1.c1ccc(N(c2ccc(-c3ccc(N4c5c(ccc6ccccc56)-c5cccc6cccc4c56)cc3)cc2)c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)cc1
• InChI: InChI=1S/C86H60N4.C63H40N2.C63H42N2.C56H36N2S.C56H38N2/c1-7-20-61(21-8-1)63-34-45-73(46-35-63)88(74-47-36-64(37-48-74)62-22-9-2-10-23-62)75-49-38-65(39-50-75)66-40-51-77(52-41-66)90-84-33-19-32-81-79(67-42-53-76(54-43-67)87(69-24-11-3-12-25-69)70-26-13-4-14-27-70)58-59-82(85(81)84)83-56-44-68-60-78(55-57-80(68)86(83)90)89(71-28-15-5-16-29-71)72-30-17-6-18-31-72;1-2-17-45(18-3-1)64(48-37-39-53-52-22-8-11-26-58(52)63(59(53)40-48)56-24-9-6-20-50(56)51-21-7-10-25-57(51)63)46-33-28-41(29-34-46)42-30-35-47(36-31-42)65-60-27-13-16-44-15-12-23-54(61(44)60)55-38-32-43-14-4-5-19-49(43)62(55)65;1-4-19-47(20-5-1)63(48-21-6-2-7-22-48)58-28-13-12-26-54(58)55-41-39-52(42-59(55)63)64(49-23-8-3-9-24-49)50-35-30-43(31-36-50)44-32-37-51(38-33-44)65-60-29-15-18-46-17-14-27-56(61(46)60)57-40-34-45-16-10-11-25-53(45)62(57)65;1-2-13-43(14-3-1)57(45-30-24-39(25-31-45)42-27-35-54-51(36-42)48-16-6-7-19-53(48)59-54)44-28-20-37(21-29-44)38-22-32-46(33-23-38)58-52-18-9-12-41-11-8-17-49(55(41)52)50-34-26-40-10-4-5-15-47(40)56(50)58;1-3-12-39(13-4-1)41-24-31-47(32-25-41)57(48-33-26-42(27-34-48)40-14-5-2-6-15-40)49-35-28-43(29-36-49)46-19-9-20-50(38-46)58-54-23-11-18-45-17-10-22-52(55(45)54)53-37-30-44-16-7-8-21-51(44)56(53)58/h1-60H;1-40H;1-42H;1-36H;1-38H
• InChIKey: HZYNBVYCGYRLLF-UHFFFAOYSA-N
• XLogP: 90.92
• TPSA: 38.88 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 39
• Heavy Atoms: 337
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4309.44
LogP ≤ 5	90.92
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Frequently Asked Questions

What is the IUPAC name of 4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline;N-[4-[3-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;N,N-diphenyl-18-[4-(N-phenylanilino)phenyl]-12-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(21),2(11),3,5(10),6,8,13,15,17,19-decaen-7-amine?

The IUPAC name of 4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline;N-[4-[3-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;N,N-diphenyl-18-[4-(N-phenylanilino)phenyl]-12-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(21),2(11),3,5(10),6,8,13,15,17,19-decaen-7-amine (CID 158637517) is 4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline;N-[4-[3-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;N,N-diphenyl-18-[4-(N-phenylanilino)phenyl]-12-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(21),2(11),3,5(10),6,8,13,15,17,19-decaen-7-amine.

What is the SMILES notation for 4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline;N-[4-[3-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;N,N-diphenyl-18-[4-(N-phenylanilino)phenyl]-12-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(21),2(11),3,5(10),6,8,13,15,17,19-decaen-7-amine?

The canonical SMILES for 4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline;N-[4-[3-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;N,N-diphenyl-18-[4-(N-phenylanilino)phenyl]-12-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(21),2(11),3,5(10),6,8,13,15,17,19-decaen-7-amine is c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N5c6c(ccc7cc(N(c8ccccc8)c8ccccc8)ccc67)-c6ccc(-c7ccc(N(c8ccccc8)c8ccccc8)cc7)c7cccc5c67)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc(N5c6c(ccc7ccccc67)-c6cccc7cccc5c67)c4)cc3)cc2)cc1.c1ccc(N(c2ccc(-c3ccc(N4c5c(ccc6ccccc56)-c5cccc6cccc4c56)cc3)cc2)c2ccc(-c3ccc4sc5ccccc5c4c3)cc2)cc1.c1ccc(N(c2ccc(-c3ccc(N4c5c(ccc6ccccc56)-c5cccc6cccc4c56)cc3)cc2)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1.c1ccc(N(c2ccc(-c3ccc(N4c5c(ccc6ccccc56)-c5cccc6cccc4c56)cc3)cc2)c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)cc1.

What is the InChIKey of 4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline;N-[4-[3-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;N,N-diphenyl-18-[4-(N-phenylanilino)phenyl]-12-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(21),2(11),3,5(10),6,8,13,15,17,19-decaen-7-amine?

The InChIKey is HZYNBVYCGYRLLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C86H60N4.C63H40N2.C63H42N2.C56H36N2S.C56H38N2/c1-7-20-61(21-8-1)63-34-45-73(46-35-63)88(74-47-36-64(37-48-74)62-22-9-2-10-23-62)75-49-38-65(39-50-75)66-40-51-77(52-41-66)90-84-33-19-32-81-79(67-42-53-76(54-43-67)87(69-24-11-3-12-25-69)70-26-13-4-14-27-70)58-59-82(85(81)84)83-56-44-68-60-78(55-57-80(68)86(83)90)89(71-28-15-5-16-29-71)72-30-17-6-18-31-72;1-2-17-45(18-3-1)64(48-37-39-53-52-22-8-11-26-58(52)63(59(53)40-48)56-24-9-6-20-50(56)51-21-7-10-25-57(51)63)46-33-28-41(29-34-46)42-30-35-47(36-31-42)65-60-27-13-16-44-15-12-23-54(61(44)60)55-38-32-43-14-4-5-19-49(43)62(55)65;1-4-19-47(20-5-1)63(48-21-6-2-7-22-48)58-28-13-12-26-54(58)55-41-39-52(42-59(55)63)64(49-23-8-3-9-24-49)50-35-30-43(31-36-50)44-32-37-51(38-33-44)65-60-29-15-18-46-17-14-27-56(61(46)60)57-40-34-45-16-10-11-25-53(45)62(57)65;1-2-13-43(14-3-1)57(45-30-24-39(25-31-45)42-27-35-54-51(36-42)48-16-6-7-19-53(48)59-54)44-28-20-37(21-29-44)38-22-32-46(33-23-38)58-52-18-9-12-41-11-8-17-49(55(41)52)50-34-26-40-10-4-5-15-47(40)56(50)58;1-3-12-39(13-4-1)41-24-31-47(32-25-41)57(48-33-26-42(27-34-48)40-14-5-2-6-15-40)49-35-28-43(29-36-49)46-19-9-20-50(38-46)58-54-23-11-18-45-17-10-22-52(55(45)54)53-37-30-44-16-7-8-21-51(44)56(53)58/h1-60H;1-40H;1-42H;1-36H;1-38H.

What are the key properties of 4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline;N-[4-[3-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;N,N-diphenyl-18-[4-(N-phenylanilino)phenyl]-12-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(21),2(11),3,5(10),6,8,13,15,17,19-decaen-7-amine?

4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline;N-[4-[3-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;N,N-diphenyl-18-[4-(N-phenylanilino)phenyl]-12-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(21),2(11),3,5(10),6,8,13,15,17,19-decaen-7-amine has a molecular weight of 4309.44 g/mol, XLogP of 90.92, 39 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline;N-[4-[3-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaen-12-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;N,N-diphenyl-18-[4-(N-phenylanilino)phenyl]-12-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-12-azapentacyclo[11.7.1.02,11.05,10.017,21]henicosa-1(21),2(11),3,5(10),6,8,13,15,17,19-decaen-7-amine is sourced from PubChem (CID 158637517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).