6-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,N-dinaphthalen-2-yl-9,10-diphenylanthracen-2-amine;3-[4-[(E)-2-[4-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)phenyl]ethenyl]phenyl]-10-(4-methylphenyl)phenoxazine;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzofuran;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzothiophene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3'-[4-[(E)-2-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-ylphenyl)ethenyl]phenyl]spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]

C₃₈₅H₂₃₂N₂O₃S₂ — CID 158978895

About 6-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,N-dinaphthalen-2-yl-9,10-diphenylanthracen-2-amine;3-[4-[(E)-2-[4-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)phenyl]ethenyl]phenyl]-10-(4-methylphenyl)phenoxazine;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzofuran;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzothiophene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3'-[4-[(E)-2-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-ylphenyl)ethenyl]phenyl]spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]

6-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,N-dinaphthalen-2-yl-9,10-diphenylanthracen-2-amine;3-[4-[(E)-2-[4-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)phenyl]ethenyl]phenyl]-10-(4-methylphenyl)phenoxazine;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzofuran;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzothiophene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3'-[4-[(E)-2-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-ylphenyl)ethenyl]phenyl]spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene] (PubChem CID 158978895) has the molecular formula C₃₈₅H₂₃₂N₂O₃S₂ and a molecular weight of 4998.24 g/mol. Its IUPAC name is 6-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,N-dinaphthalen-2-yl-9,10-diphenylanthracen-2-amine;3-[4-[(E)-2-[4-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)phenyl]ethenyl]phenyl]-10-(4-methylphenyl)phenoxazine;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzofuran;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzothiophene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3'-[4-[(E)-2-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-ylphenyl)ethenyl]phenyl]spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene].

Molecular Properties

• Compound Name: 6-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,N-dinaphthalen-2-yl-9,10-diphenylanthracen-2-amine;3-[4-[(E)-2-[4-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)phenyl]ethenyl]phenyl]-10-(4-methylphenyl)phenoxazine;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzofuran;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzothiophene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3'-[4-[(E)-2-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-ylphenyl)ethenyl]phenyl]spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]
• PubChem CID: 158978895
• Molecular Formula: C₃₈₅H₂₃₂N₂O₃S₂
• Molecular Weight: 4998.24 g/mol
• Exact Mass: 4993.75
• IUPAC Name: 6-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,N-dinaphthalen-2-yl-9,10-diphenylanthracen-2-amine;3-[4-[(E)-2-[4-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)phenyl]ethenyl]phenyl]-10-(4-methylphenyl)phenoxazine;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzofuran;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzothiophene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3'-[4-[(E)-2-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-ylphenyl)ethenyl]phenyl]spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]
• SMILES: C(=C/c1ccc(-c2cc3c4c(ccc5cccc(c54)C34c3ccccc3-c3ccccc34)c2)cc1)\c1ccc(-c2cc3c4c(ccc5cccc(c54)C34c3ccccc3-c3ccccc34)c2)cc1.Cc1ccc(N2c3ccccc3Oc3cc(-c4ccc(/C=C/c5ccc(-c6cc7c8c(ccc9cccc(c98)C7(c7ccccc7)c7ccccc7)c6)cc5)cc4)ccc32)cc1.c1ccc(-c2c3ccc(N(c4ccc5ccccc5c4)c4ccc5ccccc5c4)cc3c(-c3ccccc3)c3ccc(-c4cc5c6c(ccc7cccc(c76)C5(c5ccccc5)c5ccccc5)c4)cc23)cc1.c1ccc(-c2cc3ccc4cc(-c5cc6c7c(ccc8cccc(c87)C67c6ccccc6-c6ccccc67)c5)cc5oc(c2)c3c45)cc1.c1ccc(-c2cc3ccc4cc(-c5cc6c7c(ccc8cccc(c87)C67c6ccccc6-c6ccccc67)c5)cc5sc(c2)c3c45)cc1.c1ccc(-c2ccc3c(c2)oc2cc(-c4cc5c6c(ccc7cccc(c76)C56c5ccccc5-c5ccccc56)c4)ccc23)cc1.c1ccc(-c2ccc3c(c2)sc2cc(-c4cc5c6c(ccc7cccc(c76)C56c5ccccc5-c5ccccc56)c4)ccc23)cc1
• InChI: InChI=1S/C73H47N.C68H40.C60H41NO.C47H26O.C47H26S.C45H26O.C45H26S/c1-5-20-50(21-6-1)69-64-41-39-62(74(60-37-34-48-18-13-15-24-53(48)43-60)61-38-35-49-19-14-16-25-54(49)44-61)47-66(64)70(51-22-7-2-8-23-51)63-40-36-55(45-65(63)69)57-42-56-33-32-52-26-17-31-67-71(52)72(56)68(46-57)73(67,58-27-9-3-10-28-58)59-29-11-4-12-30-59;1-5-17-55-51(13-1)52-14-2-6-18-56(52)67(55)59-21-9-11-45-33-35-47-37-49(39-61(67)65(47)63(45)59)43-29-25-41(26-30-43)23-24-42-27-31-44(32-28-42)50-38-48-36-34-46-12-10-22-60-64(46)66(48)62(40-50)68(60)57-19-7-3-15-53(57)54-16-4-8-20-58(54)68;1-40-19-34-51(35-20-40)61-54-17-8-9-18-56(54)62-57-39-46(33-36-55(57)61)43-27-23-41(24-28-43)21-22-42-25-29-44(30-26-42)48-37-47-32-31-45-11-10-16-52-58(45)59(47)53(38-48)60(52,49-12-4-2-5-13-49)50-14-6-3-7-15-50;2*1-2-9-27(10-3-1)33-22-30-19-20-31-23-34(26-42-46(31)45(30)41(25-33)48-42)32-21-29-18-17-28-11-8-16-39-43(28)44(29)40(24-32)47(39)37-14-6-4-12-35(37)36-13-5-7-15-38(36)47;2*1-2-9-27(10-3-1)29-19-21-35-36-22-20-30(26-42(36)46-41(35)25-29)32-23-31-18-17-28-11-8-16-39-43(28)44(31)40(24-32)45(39)37-14-6-4-12-33(37)34-13-5-7-15-38(34)45/h1-47H;1-40H;2-39H,1H3;2*1-26H;2*1-26H/b;24-23+;22-21+
• InChIKey: JOSYQKJUOHSZFJ-KGZZGYFISA-N
• XLogP: 102.74
• TPSA: 41.99 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 27
• Heavy Atoms: 392
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	4998.24
LogP ≤ 5	102.74
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 6-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,N-dinaphthalen-2-yl-9,10-diphenylanthracen-2-amine;3-[4-[(E)-2-[4-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)phenyl]ethenyl]phenyl]-10-(4-methylphenyl)phenoxazine;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzofuran;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzothiophene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3'-[4-[(E)-2-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-ylphenyl)ethenyl]phenyl]spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]?

The IUPAC name of 6-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,N-dinaphthalen-2-yl-9,10-diphenylanthracen-2-amine;3-[4-[(E)-2-[4-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)phenyl]ethenyl]phenyl]-10-(4-methylphenyl)phenoxazine;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzofuran;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzothiophene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3'-[4-[(E)-2-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-ylphenyl)ethenyl]phenyl]spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene] (CID 158978895) is 6-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,N-dinaphthalen-2-yl-9,10-diphenylanthracen-2-amine;3-[4-[(E)-2-[4-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)phenyl]ethenyl]phenyl]-10-(4-methylphenyl)phenoxazine;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzofuran;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzothiophene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3'-[4-[(E)-2-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-ylphenyl)ethenyl]phenyl]spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene].

What is the SMILES notation for 6-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,N-dinaphthalen-2-yl-9,10-diphenylanthracen-2-amine;3-[4-[(E)-2-[4-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)phenyl]ethenyl]phenyl]-10-(4-methylphenyl)phenoxazine;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzofuran;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzothiophene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3'-[4-[(E)-2-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-ylphenyl)ethenyl]phenyl]spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]?

The canonical SMILES for 6-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,N-dinaphthalen-2-yl-9,10-diphenylanthracen-2-amine;3-[4-[(E)-2-[4-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)phenyl]ethenyl]phenyl]-10-(4-methylphenyl)phenoxazine;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzofuran;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzothiophene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3'-[4-[(E)-2-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-ylphenyl)ethenyl]phenyl]spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene] is C(=C/c1ccc(-c2cc3c4c(ccc5cccc(c54)C34c3ccccc3-c3ccccc34)c2)cc1)\c1ccc(-c2cc3c4c(ccc5cccc(c54)C34c3ccccc3-c3ccccc34)c2)cc1.Cc1ccc(N2c3ccccc3Oc3cc(-c4ccc(/C=C/c5ccc(-c6cc7c8c(ccc9cccc(c98)C7(c7ccccc7)c7ccccc7)c6)cc5)cc4)ccc32)cc1.c1ccc(-c2c3ccc(N(c4ccc5ccccc5c4)c4ccc5ccccc5c4)cc3c(-c3ccccc3)c3ccc(-c4cc5c6c(ccc7cccc(c76)C5(c5ccccc5)c5ccccc5)c4)cc23)cc1.c1ccc(-c2cc3ccc4cc(-c5cc6c7c(ccc8cccc(c87)C67c6ccccc6-c6ccccc67)c5)cc5oc(c2)c3c45)cc1.c1ccc(-c2cc3ccc4cc(-c5cc6c7c(ccc8cccc(c87)C67c6ccccc6-c6ccccc67)c5)cc5sc(c2)c3c45)cc1.c1ccc(-c2ccc3c(c2)oc2cc(-c4cc5c6c(ccc7cccc(c76)C56c5ccccc5-c5ccccc56)c4)ccc23)cc1.c1ccc(-c2ccc3c(c2)sc2cc(-c4cc5c6c(ccc7cccc(c76)C56c5ccccc5-c5ccccc56)c4)ccc23)cc1.

What is the InChIKey of 6-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,N-dinaphthalen-2-yl-9,10-diphenylanthracen-2-amine;3-[4-[(E)-2-[4-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)phenyl]ethenyl]phenyl]-10-(4-methylphenyl)phenoxazine;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzofuran;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzothiophene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3'-[4-[(E)-2-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-ylphenyl)ethenyl]phenyl]spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]?

The InChIKey is JOSYQKJUOHSZFJ-KGZZGYFISA-N. The full InChI is InChI=1S/C73H47N.C68H40.C60H41NO.C47H26O.C47H26S.C45H26O.C45H26S/c1-5-20-50(21-6-1)69-64-41-39-62(74(60-37-34-48-18-13-15-24-53(48)43-60)61-38-35-49-19-14-16-25-54(49)44-61)47-66(64)70(51-22-7-2-8-23-51)63-40-36-55(45-65(63)69)57-42-56-33-32-52-26-17-31-67-71(52)72(56)68(46-57)73(67,58-27-9-3-10-28-58)59-29-11-4-12-30-59;1-5-17-55-51(13-1)52-14-2-6-18-56(52)67(55)59-21-9-11-45-33-35-47-37-49(39-61(67)65(47)63(45)59)43-29-25-41(26-30-43)23-24-42-27-31-44(32-28-42)50-38-48-36-34-46-12-10-22-60-64(46)66(48)62(40-50)68(60)57-19-7-3-15-53(57)54-16-4-8-20-58(54)68;1-40-19-34-51(35-20-40)61-54-17-8-9-18-56(54)62-57-39-46(33-36-55(57)61)43-27-23-41(24-28-43)21-22-42-25-29-44(30-26-42)48-37-47-32-31-45-11-10-16-52-58(45)59(47)53(38-48)60(52,49-12-4-2-5-13-49)50-14-6-3-7-15-50;2*1-2-9-27(10-3-1)33-22-30-19-20-31-23-34(26-42-46(31)45(30)41(25-33)48-42)32-21-29-18-17-28-11-8-16-39-43(28)44(29)40(24-32)47(39)37-14-6-4-12-35(37)36-13-5-7-15-38(36)47;2*1-2-9-27(10-3-1)29-19-21-35-36-22-20-30(26-42(36)46-41(35)25-29)32-23-31-18-17-28-11-8-16-39-43(28)44(31)40(24-32)45(39)37-14-6-4-12-33(37)34-13-5-7-15-38(34)45/h1-47H;1-40H;2-39H,1H3;2*1-26H;2*1-26H/b;24-23+;22-21+;;;;.

What are the key properties of 6-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,N-dinaphthalen-2-yl-9,10-diphenylanthracen-2-amine;3-[4-[(E)-2-[4-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)phenyl]ethenyl]phenyl]-10-(4-methylphenyl)phenoxazine;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzofuran;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzothiophene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3'-[4-[(E)-2-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-ylphenyl)ethenyl]phenyl]spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]?

6-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,N-dinaphthalen-2-yl-9,10-diphenylanthracen-2-amine;3-[4-[(E)-2-[4-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)phenyl]ethenyl]phenyl]-10-(4-methylphenyl)phenoxazine;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzofuran;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzothiophene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3'-[4-[(E)-2-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-ylphenyl)ethenyl]phenyl]spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene] has a molecular weight of 4998.24 g/mol, XLogP of 102.74, 27 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,N-dinaphthalen-2-yl-9,10-diphenylanthracen-2-amine;3-[4-[(E)-2-[4-(15,15-diphenyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)phenyl]ethenyl]phenyl]-10-(4-methylphenyl)phenoxazine;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzofuran;3-phenyl-7-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yldibenzothiophene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3-phenyl-10-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-yl-15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;3'-[4-[(E)-2-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene]-3'-ylphenyl)ethenyl]phenyl]spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene] is sourced from PubChem (CID 158978895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 158978895 — identifiers, structure, computed properties (public domain)

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