24-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2,4-diphenyl-6-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]pyrimidine;2-methyl-1-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]benzimidazole;24-[10-(4-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;24-[10-[10-(trifluoromethyl)anthracen-9-yl]anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene

C383H219F3N4O4S3 — CID 159393370

About 24-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2,4-diphenyl-6-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]pyrimidine;2-methyl-1-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]benzimidazole;24-[10-(4-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;24-[10-[10-(trifluoromethyl)anthracen-9-yl]anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene

24-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2,4-diphenyl-6-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]pyrimidine;2-methyl-1-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]benzimidazole;24-[10-(4-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;24-[10-[10-(trifluoromethyl)anthracen-9-yl]anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene (PubChem CID 159393370) has the molecular formula C383H219F3N4O4S3 and a molecular weight of 5094.18 g/mol. Its IUPAC name is 24-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2,4-diphenyl-6-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]pyrimidine;2-methyl-1-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]benzimidazole;24-[10-(4-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;24-[10-[10-(trifluoromethyl)anthracen-9-yl]anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene.

Molecular Properties

• Compound Name: 24-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2,4-diphenyl-6-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]pyrimidine;2-methyl-1-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]benzimidazole;24-[10-(4-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;24-[10-[10-(trifluoromethyl)anthracen-9-yl]anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene
• PubChem CID: 159393370
• Molecular Formula: C383H219F3N4O4S3
• Molecular Weight: 5094.18 g/mol
• Exact Mass: 5089.62
• IUPAC Name: 24-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2,4-diphenyl-6-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]pyrimidine;2-methyl-1-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]benzimidazole;24-[10-(4-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;24-[10-[10-(trifluoromethyl)anthracen-9-yl]anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene
• SMILES: Cc1nc2ccccc2n1-c1c2ccccc2c(-c2c3ccccc3c(-c3ccc4sc5cc6c7ccccc7c7cc8ccccc8cc7c6cc5c4c3)c3ccccc23)c2ccccc12.FC(F)(F)c1c2ccccc2c(-c2c3ccccc3c(-c3ccc4c(c3)oc3cc5c6ccccc6c6cc7ccccc7cc6c5cc34)c3ccccc23)c2ccccc12.c1ccc(-c2cc(-c3c4ccccc4c(-c4c5ccccc5c(-c5ccc6sc7cc8c9ccccc9c9cc%10ccccc%10cc9c8cc7c6c5)c5ccccc45)c4ccccc34)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cccc3c(-c4c5ccccc5c(-c5ccc6c(c5)oc5cc7c8ccccc8c8cc9ccccc9cc8c7cc56)c5ccccc45)c4ccccc4cc23)cc1.c1ccc2cc3c(cc2c1)c1ccccc1c1cc2oc4cc(-c5c6ccccc6c(-c6c7ccccc7cc7ccccc67)c6ccccc56)ccc4c2cc31.c1ccc2cc3c(cc2c1)oc1ccc(-c2c4ccccc4c(-c4c5ccccc5c(-c5ccc6sc7cc8c9ccccc9c9cc%10ccccc%10cc9c8cc7c6c5)c5ccccc45)c4ccccc24)cc13
• InChI: InChI=1S/C72H42N2S.C72H40OS.C64H38N2S.C62H36O.C57H31F3O.C56H32O/c1-3-19-43(20-4-1)64-42-65(74-72(73-64)44-21-5-2-6-22-44)69-52-29-13-17-33-56(52)71(57-34-18-14-30-53(57)69)70-54-31-15-11-27-50(54)68(51-28-12-16-32-55(51)70)47-35-36-66-62(39-47)63-40-60-59-38-46-24-8-7-23-45(46)37-58(59)48-25-9-10-26-49(48)61(60)41-67(63)75-66;1-2-16-42-34-58-57(33-41(42)15-1)47-19-5-6-20-48(47)60-40-68-64(39-59(58)60)63-37-46(30-32-67(63)74-68)70-51-23-9-13-27-55(51)72(56-28-14-10-24-52(56)70)71-53-25-11-7-21-49(53)69(50-22-8-12-26-54(50)71)45-29-31-65-61(36-45)62-35-43-17-3-4-18-44(43)38-66(62)73-65;1-37-65-57-28-14-15-29-58(57)66(37)64-49-26-12-10-24-47(49)63(48-25-11-13-27-50(48)64)62-45-22-8-6-20-43(45)61(44-21-7-9-23-46(44)62)40-30-31-59-55(34-40)56-35-53-52-33-39-17-3-2-16-38(39)32-51(52)41-18-4-5-19-42(41)54(53)36-60(56)67-59;1-2-15-37(16-3-1)42-27-14-28-51-52(42)33-40-19-6-7-20-43(40)61(51)62-49-25-12-10-23-47(49)60(48-24-11-13-26-50(48)62)41-29-30-46-57-35-55-54-32-39-18-5-4-17-38(39)31-53(54)44-21-8-9-22-45(44)56(55)36-59(57)63-58(46)34-41;58-57(59,60)56-44-23-11-9-21-42(44)55(43-22-10-12-24-45(43)56)54-40-19-7-5-17-38(40)53(39-18-6-8-20-41(39)54)34-25-26-37-50-30-48-47-28-33-14-2-1-13-32(33)27-46(47)35-15-3-4-16-36(35)49(48)31-52(50)61-51(37)29-34;1-2-14-34-29-48-47(28-33(34)13-1)40-19-7-8-20-41(40)50-32-53-51(31-49(48)50)42-26-25-37(30-52(42)57-53)54-43-21-9-11-23-45(43)56(46-24-12-10-22-44(46)54)55-38-17-5-3-15-35(38)27-36-16-4-6-18-39(36)55/h1-42H;1-40H;2-36H,1H3;1-36H;1-31H;1-32H
• InChIKey: LMKFARMPHVUVCO-UHFFFAOYSA-N
• XLogP: 111.12
• TPSA: 96.16 Ų
• H-Bond Acceptors: 11
• Rotatable Bonds: 18
• Heavy Atoms: 397
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5094.18
LogP ≤ 5	111.12
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	11

Frequently Asked Questions

What is the IUPAC name of 24-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2,4-diphenyl-6-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]pyrimidine;2-methyl-1-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]benzimidazole;24-[10-(4-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;24-[10-[10-(trifluoromethyl)anthracen-9-yl]anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene?

The IUPAC name of 24-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2,4-diphenyl-6-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]pyrimidine;2-methyl-1-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]benzimidazole;24-[10-(4-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;24-[10-[10-(trifluoromethyl)anthracen-9-yl]anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene (CID 159393370) is 24-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2,4-diphenyl-6-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]pyrimidine;2-methyl-1-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]benzimidazole;24-[10-(4-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;24-[10-[10-(trifluoromethyl)anthracen-9-yl]anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene.

What is the SMILES notation for 24-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2,4-diphenyl-6-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]pyrimidine;2-methyl-1-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]benzimidazole;24-[10-(4-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;24-[10-[10-(trifluoromethyl)anthracen-9-yl]anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene?

The canonical SMILES for 24-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2,4-diphenyl-6-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]pyrimidine;2-methyl-1-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]benzimidazole;24-[10-(4-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;24-[10-[10-(trifluoromethyl)anthracen-9-yl]anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene is Cc1nc2ccccc2n1-c1c2ccccc2c(-c2c3ccccc3c(-c3ccc4sc5cc6c7ccccc7c7cc8ccccc8cc7c6cc5c4c3)c3ccccc23)c2ccccc12.FC(F)(F)c1c2ccccc2c(-c2c3ccccc3c(-c3ccc4c(c3)oc3cc5c6ccccc6c6cc7ccccc7cc6c5cc34)c3ccccc23)c2ccccc12.c1ccc(-c2cc(-c3c4ccccc4c(-c4c5ccccc5c(-c5ccc6sc7cc8c9ccccc9c9cc%10ccccc%10cc9c8cc7c6c5)c5ccccc45)c4ccccc34)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cccc3c(-c4c5ccccc5c(-c5ccc6c(c5)oc5cc7c8ccccc8c8cc9ccccc9cc8c7cc56)c5ccccc45)c4ccccc4cc23)cc1.c1ccc2cc3c(cc2c1)c1ccccc1c1cc2oc4cc(-c5c6ccccc6c(-c6c7ccccc7cc7ccccc67)c6ccccc56)ccc4c2cc31.c1ccc2cc3c(cc2c1)oc1ccc(-c2c4ccccc4c(-c4c5ccccc5c(-c5ccc6sc7cc8c9ccccc9c9cc%10ccccc%10cc9c8cc7c6c5)c5ccccc45)c4ccccc24)cc13.

What is the InChIKey of 24-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2,4-diphenyl-6-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]pyrimidine;2-methyl-1-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]benzimidazole;24-[10-(4-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;24-[10-[10-(trifluoromethyl)anthracen-9-yl]anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene?

The InChIKey is LMKFARMPHVUVCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H42N2S.C72H40OS.C64H38N2S.C62H36O.C57H31F3O.C56H32O/c1-3-19-43(20-4-1)64-42-65(74-72(73-64)44-21-5-2-6-22-44)69-52-29-13-17-33-56(52)71(57-34-18-14-30-53(57)69)70-54-31-15-11-27-50(54)68(51-28-12-16-32-55(51)70)47-35-36-66-62(39-47)63-40-60-59-38-46-24-8-7-23-45(46)37-58(59)48-25-9-10-26-49(48)61(60)41-67(63)75-66;1-2-16-42-34-58-57(33-41(42)15-1)47-19-5-6-20-48(47)60-40-68-64(39-59(58)60)63-37-46(30-32-67(63)74-68)70-51-23-9-13-27-55(51)72(56-28-14-10-24-52(56)70)71-53-25-11-7-21-49(53)69(50-22-8-12-26-54(50)71)45-29-31-65-61(36-45)62-35-43-17-3-4-18-44(43)38-66(62)73-65;1-37-65-57-28-14-15-29-58(57)66(37)64-49-26-12-10-24-47(49)63(48-25-11-13-27-50(48)64)62-45-22-8-6-20-43(45)61(44-21-7-9-23-46(44)62)40-30-31-59-55(34-40)56-35-53-52-33-39-17-3-2-16-38(39)32-51(52)41-18-4-5-19-42(41)54(53)36-60(56)67-59;1-2-15-37(16-3-1)42-27-14-28-51-52(42)33-40-19-6-7-20-43(40)61(51)62-49-25-12-10-23-47(49)60(48-24-11-13-26-50(48)62)41-29-30-46-57-35-55-54-32-39-18-5-4-17-38(39)31-53(54)44-21-8-9-22-45(44)56(55)36-59(57)63-58(46)34-41;58-57(59,60)56-44-23-11-9-21-42(44)55(43-22-10-12-24-45(43)56)54-40-19-7-5-17-38(40)53(39-18-6-8-20-41(39)54)34-25-26-37-50-30-48-47-28-33-14-2-1-13-32(33)27-46(47)35-15-3-4-16-36(35)49(48)31-52(50)61-51(37)29-34;1-2-14-34-29-48-47(28-33(34)13-1)40-19-7-8-20-41(40)50-32-53-51(31-49(48)50)42-26-25-37(30-52(42)57-53)54-43-21-9-11-23-45(43)56(46-24-12-10-22-44(46)54)55-38-17-5-3-15-35(38)27-36-16-4-6-18-39(36)55/h1-42H;1-40H;2-36H,1H3;1-36H;1-31H;1-32H.

What are the key properties of 24-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2,4-diphenyl-6-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]pyrimidine;2-methyl-1-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]benzimidazole;24-[10-(4-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;24-[10-[10-(trifluoromethyl)anthracen-9-yl]anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene?

24-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2,4-diphenyl-6-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]pyrimidine;2-methyl-1-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]benzimidazole;24-[10-(4-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;24-[10-[10-(trifluoromethyl)anthracen-9-yl]anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene has a molecular weight of 5094.18 g/mol, XLogP of 111.12, 18 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for 24-(10-anthracen-9-ylanthracen-9-yl)-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2,4-diphenyl-6-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]pyrimidine;2-methyl-1-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]benzimidazole;24-[10-(4-phenylanthracen-9-yl)anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene;2-[10-[10-(21-thiaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(29),2,4,6,8,10,12,14,16,18,20(28),22(27),23,25-tetradecaen-25-yl)anthracen-9-yl]anthracen-9-yl]naphtho[2,3-b][1]benzofuran;24-[10-[10-(trifluoromethyl)anthracen-9-yl]anthracen-9-yl]-21-oxaheptacyclo[16.11.0.02,11.04,9.012,17.020,28.022,27]nonacosa-1(18),2,4,6,8,10,12,14,16,19,22(27),23,25,28-tetradecaene is sourced from PubChem (CID 159393370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).