6-[5-[4b,8a-dimethyl-9-(4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-(4-methylphenyl)-1,2,3,4-tetrahydrocarbazole;6-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;[4-[6-[5-[4b,8a-dimethyl-9-(4-trimethylsilylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]phenyl]-trimethylsilane;9-(4-fluorophenyl)-6-[5-[9-(4-fluorophenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole

C300H274F2N8Si2 — CID 158150005

About 6-[5-[4b,8a-dimethyl-9-(4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-(4-methylphenyl)-1,2,3,4-tetrahydrocarbazole;6-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;[4-[6-[5-[4b,8a-dimethyl-9-(4-trimethylsilylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]phenyl]-trimethylsilane;9-(4-fluorophenyl)-6-[5-[9-(4-fluorophenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole

6-[5-[4b,8a-dimethyl-9-(4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-(4-methylphenyl)-1,2,3,4-tetrahydrocarbazole;6-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;[4-[6-[5-[4b,8a-dimethyl-9-(4-trimethylsilylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]phenyl]-trimethylsilane;9-(4-fluorophenyl)-6-[5-[9-(4-fluorophenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole (PubChem CID 158150005) has the molecular formula C300H274F2N8Si2 and a molecular weight of 4085.72 g/mol. Its IUPAC name is 6-[5-[4b,8a-dimethyl-9-(4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-(4-methylphenyl)-1,2,3,4-tetrahydrocarbazole;6-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;[4-[6-[5-[4b,8a-dimethyl-9-(4-trimethylsilylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]phenyl]-trimethylsilane;9-(4-fluorophenyl)-6-[5-[9-(4-fluorophenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole.

Molecular Properties

• Compound Name: 6-[5-[4b,8a-dimethyl-9-(4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-(4-methylphenyl)-1,2,3,4-tetrahydrocarbazole;6-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;[4-[6-[5-[4b,8a-dimethyl-9-(4-trimethylsilylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]phenyl]-trimethylsilane;9-(4-fluorophenyl)-6-[5-[9-(4-fluorophenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole
• PubChem CID: 158150005
• Molecular Formula: C300H274F2N8Si2
• Molecular Weight: 4085.72 g/mol
• Exact Mass: 4082.12
• IUPAC Name: 6-[5-[4b,8a-dimethyl-9-(4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-(4-methylphenyl)-1,2,3,4-tetrahydrocarbazole;6-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;[4-[6-[5-[4b,8a-dimethyl-9-(4-trimethylsilylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]phenyl]-trimethylsilane;9-(4-fluorophenyl)-6-[5-[9-(4-fluorophenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole
• SMILES: CC12CCCCC1(C)N(c1ccc(F)cc1)c1ccc(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3c-4c4ccccc4c4cc(-c5ccc6c(c5)C5(C)CCCCC5(C)N6c5ccc(F)cc5)ccc34)cc12.CC12CCCCC1(C)N(c1ccc([Si](C)(C)C)cc1)c1ccc(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3c-4c4ccccc4c4cc(-c5ccc6c(c5)C5(C)CCCCC5(C)N6c5ccc([Si](C)(C)C)cc5)ccc34)cc12.CC12CCCCC1(C)N(c1ccccc1)c1ccc(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3c-4c4ccccc4c4cc(-c5ccc6c(c5)C5(C)CCCCC5(C)N6c5ccccc5)ccc34)cc12.Cc1ccc(N2c3ccc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4c-5c5ccccc5c5cc(-c6ccc7c(c6)C6(C)CCCCC6(C)N7c6ccc(C)cc6)ccc45)cc3C3(C)CCCCC23C)cc1
• InChI: InChI=1S/C79H80N2Si2.C75H68N2.C73H62F2N2.C73H64N2/c1-75-45-19-21-47-77(75,3)80(59-33-37-61(38-34-59)82(5,6)7)71-43-31-55(51-69(71)75)53-29-41-65-67(49-53)63-27-17-18-28-64(63)73-66-42-30-54(50-68(66)79(74(65)73,57-23-13-11-14-24-57)58-25-15-12-16-26-58)56-32-44-72-70(52-56)76(2)46-20-22-48-78(76,4)81(72)60-35-39-62(40-36-60)83(8,9)10;1-49-25-33-57(34-26-49)76-67-39-31-53(47-65(67)71(3)41-15-17-43-73(71,76)5)51-29-37-61-63(45-51)59-23-13-14-24-60(59)69-62-38-30-52(46-64(62)75(70(61)69,55-19-9-7-10-20-55)56-21-11-8-12-22-56)54-32-40-68-66(48-54)72(4)42-16-18-44-74(72,6)77(68)58-35-27-50(2)28-36-58;1-69-39-13-15-41-71(69,3)76(55-31-27-53(74)28-32-55)65-37-25-49(45-63(65)69)47-23-35-59-61(43-47)57-21-11-12-22-58(57)67-60-36-24-48(44-62(60)73(68(59)67,51-17-7-5-8-18-51)52-19-9-6-10-20-52)50-26-38-66-64(46-50)70(2)40-14-16-42-72(70,4)77(66)56-33-29-54(75)30-34-56;1-69-41-19-21-43-71(69,3)74(55-27-13-7-14-28-55)65-39-35-51(47-63(65)69)49-33-37-59-61(45-49)57-31-17-18-32-58(57)67-60-38-34-50(46-62(60)73(68(59)67,53-23-9-5-10-24-53)54-25-11-6-12-26-54)52-36-40-66-64(48-52)70(2)42-20-22-44-72(70,4)75(66)56-29-15-8-16-30-56/h11-18,23-44,49-52H,19-22,45-48H2,1-10H3;7-14,19-40,45-48H,15-18,41-44H2,1-6H3;5-12,17-38,43-46H,13-16,39-42H2,1-4H3;5-18,23-40,45-48H,19-22,41-44H2,1-4H3
• InChIKey: FUZJJHCTGJFYCG-UHFFFAOYSA-N
• XLogP: 78.68
• TPSA: 25.92 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 26
• Heavy Atoms: 312
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	4085.72
LogP ≤ 5	78.68
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 6-[5-[4b,8a-dimethyl-9-(4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-(4-methylphenyl)-1,2,3,4-tetrahydrocarbazole;6-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;[4-[6-[5-[4b,8a-dimethyl-9-(4-trimethylsilylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]phenyl]-trimethylsilane;9-(4-fluorophenyl)-6-[5-[9-(4-fluorophenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole?

The IUPAC name of 6-[5-[4b,8a-dimethyl-9-(4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-(4-methylphenyl)-1,2,3,4-tetrahydrocarbazole;6-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;[4-[6-[5-[4b,8a-dimethyl-9-(4-trimethylsilylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]phenyl]-trimethylsilane;9-(4-fluorophenyl)-6-[5-[9-(4-fluorophenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole (CID 158150005) is 6-[5-[4b,8a-dimethyl-9-(4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-(4-methylphenyl)-1,2,3,4-tetrahydrocarbazole;6-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;[4-[6-[5-[4b,8a-dimethyl-9-(4-trimethylsilylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]phenyl]-trimethylsilane;9-(4-fluorophenyl)-6-[5-[9-(4-fluorophenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole.

What is the SMILES notation for 6-[5-[4b,8a-dimethyl-9-(4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-(4-methylphenyl)-1,2,3,4-tetrahydrocarbazole;6-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;[4-[6-[5-[4b,8a-dimethyl-9-(4-trimethylsilylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]phenyl]-trimethylsilane;9-(4-fluorophenyl)-6-[5-[9-(4-fluorophenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole?

The canonical SMILES for 6-[5-[4b,8a-dimethyl-9-(4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-(4-methylphenyl)-1,2,3,4-tetrahydrocarbazole;6-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;[4-[6-[5-[4b,8a-dimethyl-9-(4-trimethylsilylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]phenyl]-trimethylsilane;9-(4-fluorophenyl)-6-[5-[9-(4-fluorophenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole is CC12CCCCC1(C)N(c1ccc(F)cc1)c1ccc(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3c-4c4ccccc4c4cc(-c5ccc6c(c5)C5(C)CCCCC5(C)N6c5ccc(F)cc5)ccc34)cc12.CC12CCCCC1(C)N(c1ccc([Si](C)(C)C)cc1)c1ccc(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3c-4c4ccccc4c4cc(-c5ccc6c(c5)C5(C)CCCCC5(C)N6c5ccc([Si](C)(C)C)cc5)ccc34)cc12.CC12CCCCC1(C)N(c1ccccc1)c1ccc(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3c-4c4ccccc4c4cc(-c5ccc6c(c5)C5(C)CCCCC5(C)N6c5ccccc5)ccc34)cc12.Cc1ccc(N2c3ccc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4c-5c5ccccc5c5cc(-c6ccc7c(c6)C6(C)CCCCC6(C)N7c6ccc(C)cc6)ccc45)cc3C3(C)CCCCC23C)cc1.

What is the InChIKey of 6-[5-[4b,8a-dimethyl-9-(4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-(4-methylphenyl)-1,2,3,4-tetrahydrocarbazole;6-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;[4-[6-[5-[4b,8a-dimethyl-9-(4-trimethylsilylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]phenyl]-trimethylsilane;9-(4-fluorophenyl)-6-[5-[9-(4-fluorophenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole?

The InChIKey is FUZJJHCTGJFYCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C79H80N2Si2.C75H68N2.C73H62F2N2.C73H64N2/c1-75-45-19-21-47-77(75,3)80(59-33-37-61(38-34-59)82(5,6)7)71-43-31-55(51-69(71)75)53-29-41-65-67(49-53)63-27-17-18-28-64(63)73-66-42-30-54(50-68(66)79(74(65)73,57-23-13-11-14-24-57)58-25-15-12-16-26-58)56-32-44-72-70(52-56)76(2)46-20-22-48-78(76,4)81(72)60-35-39-62(40-36-60)83(8,9)10;1-49-25-33-57(34-26-49)76-67-39-31-53(47-65(67)71(3)41-15-17-43-73(71,76)5)51-29-37-61-63(45-51)59-23-13-14-24-60(59)69-62-38-30-52(46-64(62)75(70(61)69,55-19-9-7-10-20-55)56-21-11-8-12-22-56)54-32-40-68-66(48-54)72(4)42-16-18-44-74(72,6)77(68)58-35-27-50(2)28-36-58;1-69-39-13-15-41-71(69,3)76(55-31-27-53(74)28-32-55)65-37-25-49(45-63(65)69)47-23-35-59-61(43-47)57-21-11-12-22-58(57)67-60-36-24-48(44-62(60)73(68(59)67,51-17-7-5-8-18-51)52-19-9-6-10-20-52)50-26-38-66-64(46-50)70(2)40-14-16-42-72(70,4)77(66)56-33-29-54(75)30-34-56;1-69-41-19-21-43-71(69,3)74(55-27-13-7-14-28-55)65-39-35-51(47-63(65)69)49-33-37-59-61(45-49)57-31-17-18-32-58(57)67-60-38-34-50(46-62(60)73(68(59)67,53-23-9-5-10-24-53)54-25-11-6-12-26-54)52-36-40-66-64(48-52)70(2)42-20-22-44-72(70,4)75(66)56-29-15-8-16-30-56/h11-18,23-44,49-52H,19-22,45-48H2,1-10H3;7-14,19-40,45-48H,15-18,41-44H2,1-6H3;5-12,17-38,43-46H,13-16,39-42H2,1-4H3;5-18,23-40,45-48H,19-22,41-44H2,1-4H3.

What are the key properties of 6-[5-[4b,8a-dimethyl-9-(4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-(4-methylphenyl)-1,2,3,4-tetrahydrocarbazole;6-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;[4-[6-[5-[4b,8a-dimethyl-9-(4-trimethylsilylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]phenyl]-trimethylsilane;9-(4-fluorophenyl)-6-[5-[9-(4-fluorophenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole?

6-[5-[4b,8a-dimethyl-9-(4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-(4-methylphenyl)-1,2,3,4-tetrahydrocarbazole;6-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;[4-[6-[5-[4b,8a-dimethyl-9-(4-trimethylsilylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]phenyl]-trimethylsilane;9-(4-fluorophenyl)-6-[5-[9-(4-fluorophenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole has a molecular weight of 4085.72 g/mol, XLogP of 78.68, 26 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[5-[4b,8a-dimethyl-9-(4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-(4-methylphenyl)-1,2,3,4-tetrahydrocarbazole;6-[5-(4b,8a-dimethyl-9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-9-phenyl-1,2,3,4-tetrahydrocarbazole;[4-[6-[5-[4b,8a-dimethyl-9-(4-trimethylsilylphenyl)-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl]phenyl]-trimethylsilane;9-(4-fluorophenyl)-6-[5-[9-(4-fluorophenyl)-4b,8a-dimethyl-5,6,7,8-tetrahydrocarbazol-3-yl]-21,21-diphenyl-18-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaenyl]-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazole is sourced from PubChem (CID 158150005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).