17,19-bis[9,9-bis(4-methoxyphenyl)fluoren-4-yl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9-phenylcarbazol-2-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene

C394H266N14O4S6 — CID 158339503

About 17,19-bis[9,9-bis(4-methoxyphenyl)fluoren-4-yl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9-phenylcarbazol-2-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene

17,19-bis[9,9-bis(4-methoxyphenyl)fluoren-4-yl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9-phenylcarbazol-2-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene (PubChem CID 158339503) has the molecular formula C394H266N14O4S6 and a molecular weight of 5452.96 g/mol. Its IUPAC name is 17,19-bis[9,9-bis(4-methoxyphenyl)fluoren-4-yl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9-phenylcarbazol-2-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene.

Molecular Properties

• Compound Name: 17,19-bis[9,9-bis(4-methoxyphenyl)fluoren-4-yl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9-phenylcarbazol-2-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene
• PubChem CID: 158339503
• Molecular Formula: C394H266N14O4S6
• Molecular Weight: 5452.96 g/mol
• Exact Mass: 5447.94
• IUPAC Name: 17,19-bis[9,9-bis(4-methoxyphenyl)fluoren-4-yl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9-phenylcarbazol-2-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene
• SMILES: CC(C)(C)c1ccc2c(c1)C1(c3cc(C(C)(C)C)ccc3-2)c2ccccc2-c2c(-c3sc(-c4cccc5c4-c4ccccc4C54c5cc(C(C)(C)C)ccc5-c5ccc(C(C)(C)C)cc54)c4nc5c6ccccc6c6ccccc6c5nc34)cccc21.CC1(C)c2ccccc2-c2c(-c3sc(-c4cccc5c4-c4ccccc4C5(C)C)c4nc5c6ccccc6c6ccccc6c5nc34)cccc21.COc1ccc(C2(c3ccc(OC)cc3)c3ccccc3-c3c(-c4sc(-c5cccc6c5-c5ccccc5C6(c5ccc(OC)cc5)c5ccc(OC)cc5)c5nc6c7ccccc7c7ccccc7c6nc45)cccc32)cc1.c1ccc(-n2c3ccccc3c3ccc(-c4sc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c5nc6c7ccccc7c7ccccc7c6nc45)cc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3c(-c4sc(-c5cccc6c5-c5ccccc5C6(c5ccccc5)c5ccccc5)c5nc6c7ccccc7c7ccccc7c6nc45)cccc32)cc1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2c(-c3sc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)c4nc5c6ccccc6c6ccccc6c5nc34)cccc21
• InChI: InChI=1S/C84H70N2S.C72H50N2O4S.C68H38N2S.C68H42N2S.C54H32N4S.C48H34N2S/c1-79(2,3)47-35-39-53-54-40-36-48(80(4,5)6)44-68(54)83(67(53)43-47)63-31-19-17-27-59(63)71-61(29-21-33-65(71)83)77-75-76(86-74-58-26-16-14-24-52(58)51-23-13-15-25-57(51)73(74)85-75)78(87-77)62-30-22-34-66-72(62)60-28-18-20-32-64(60)84(66)69-45-49(81(7,8)9)37-41-55(69)56-42-38-50(46-70(56)84)82(10,11)12;1-75-47-35-27-43(28-36-47)71(44-29-37-48(76-2)38-30-44)59-23-11-9-19-55(59)63-57(21-13-25-61(63)71)69-67-68(74-66-54-18-8-6-16-52(54)51-15-5-7-17-53(51)65(66)73-67)70(79-69)58-22-14-26-62-64(58)56-20-10-12-24-60(56)72(62,45-31-39-49(77-3)40-32-45)46-33-41-50(78-4)42-34-46;1-3-25-45-39(19-1)40-20-2-4-26-46(40)62-61(45)69-63-64(70-62)66(50-30-18-38-58-60(50)48-28-10-16-36-56(48)68(58)53-33-13-7-23-43(53)44-24-8-14-34-54(44)68)71-65(63)49-29-17-37-57-59(49)47-27-9-15-35-55(47)67(57)51-31-11-5-21-41(51)42-22-6-12-32-52(42)67;1-5-23-43(24-6-1)67(44-25-7-2-8-26-44)55-39-19-17-35-51(55)59-53(37-21-41-57(59)67)65-63-64(70-62-50-34-16-14-32-48(50)47-31-13-15-33-49(47)61(62)69-63)66(71-65)54-38-22-42-58-60(54)52-36-18-20-40-56(52)68(58,45-27-9-3-10-28-45)46-29-11-4-12-30-46;1-3-15-35(16-4-1)57-45-25-13-11-21-39(45)41-29-27-33(31-47(41)57)53-51-52(56-50-44-24-10-8-20-38(44)37-19-7-9-23-43(37)49(50)55-51)54(59-53)34-28-30-42-40-22-12-14-26-46(40)58(48(42)32-34)36-17-5-2-6-18-36;1-47(2)35-23-11-9-19-31(35)39-33(21-13-25-37(39)47)45-43-44(50-42-30-18-8-6-16-28(30)27-15-5-7-17-29(27)41(42)49-43)46(51-45)34-22-14-26-38-40(34)32-20-10-12-24-36(32)48(38,3)4/h13-46H,1-12H3;5-42H,1-4H3;1-38H;1-42H;1-32H;5-26H,1-4H3
• InChIKey: GQZGMNSMINGMKX-UHFFFAOYSA-N
• XLogP: 101.77
• TPSA: 201.46 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 26
• Heavy Atoms: 418
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5452.96
LogP ≤ 5	101.77
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 17,19-bis[9,9-bis(4-methoxyphenyl)fluoren-4-yl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9-phenylcarbazol-2-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene?

The IUPAC name of 17,19-bis[9,9-bis(4-methoxyphenyl)fluoren-4-yl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9-phenylcarbazol-2-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene (CID 158339503) is 17,19-bis[9,9-bis(4-methoxyphenyl)fluoren-4-yl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9-phenylcarbazol-2-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene.

What is the SMILES notation for 17,19-bis[9,9-bis(4-methoxyphenyl)fluoren-4-yl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9-phenylcarbazol-2-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene?

The canonical SMILES for 17,19-bis[9,9-bis(4-methoxyphenyl)fluoren-4-yl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9-phenylcarbazol-2-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene is CC(C)(C)c1ccc2c(c1)C1(c3cc(C(C)(C)C)ccc3-2)c2ccccc2-c2c(-c3sc(-c4cccc5c4-c4ccccc4C54c5cc(C(C)(C)C)ccc5-c5ccc(C(C)(C)C)cc54)c4nc5c6ccccc6c6ccccc6c5nc34)cccc21.CC1(C)c2ccccc2-c2c(-c3sc(-c4cccc5c4-c4ccccc4C5(C)C)c4nc5c6ccccc6c6ccccc6c5nc34)cccc21.COc1ccc(C2(c3ccc(OC)cc3)c3ccccc3-c3c(-c4sc(-c5cccc6c5-c5ccccc5C6(c5ccc(OC)cc5)c5ccc(OC)cc5)c5nc6c7ccccc7c7ccccc7c6nc45)cccc32)cc1.c1ccc(-n2c3ccccc3c3ccc(-c4sc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c5nc6c7ccccc7c7ccccc7c6nc45)cc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3c(-c4sc(-c5cccc6c5-c5ccccc5C6(c5ccccc5)c5ccccc5)c5nc6c7ccccc7c7ccccc7c6nc45)cccc32)cc1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2c(-c3sc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)c4nc5c6ccccc6c6ccccc6c5nc34)cccc21.

What is the InChIKey of 17,19-bis[9,9-bis(4-methoxyphenyl)fluoren-4-yl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9-phenylcarbazol-2-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene?

The InChIKey is GQZGMNSMINGMKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C84H70N2S.C72H50N2O4S.C68H38N2S.C68H42N2S.C54H32N4S.C48H34N2S/c1-79(2,3)47-35-39-53-54-40-36-48(80(4,5)6)44-68(54)83(67(53)43-47)63-31-19-17-27-59(63)71-61(29-21-33-65(71)83)77-75-76(86-74-58-26-16-14-24-52(58)51-23-13-15-25-57(51)73(74)85-75)78(87-77)62-30-22-34-66-72(62)60-28-18-20-32-64(60)84(66)69-45-49(81(7,8)9)37-41-55(69)56-42-38-50(46-70(56)84)82(10,11)12;1-75-47-35-27-43(28-36-47)71(44-29-37-48(76-2)38-30-44)59-23-11-9-19-55(59)63-57(21-13-25-61(63)71)69-67-68(74-66-54-18-8-6-16-52(54)51-15-5-7-17-53(51)65(66)73-67)70(79-69)58-22-14-26-62-64(58)56-20-10-12-24-60(56)72(62,45-31-39-49(77-3)40-32-45)46-33-41-50(78-4)42-34-46;1-3-25-45-39(19-1)40-20-2-4-26-46(40)62-61(45)69-63-64(70-62)66(50-30-18-38-58-60(50)48-28-10-16-36-56(48)68(58)53-33-13-7-23-43(53)44-24-8-14-34-54(44)68)71-65(63)49-29-17-37-57-59(49)47-27-9-15-35-55(47)67(57)51-31-11-5-21-41(51)42-22-6-12-32-52(42)67;1-5-23-43(24-6-1)67(44-25-7-2-8-26-44)55-39-19-17-35-51(55)59-53(37-21-41-57(59)67)65-63-64(70-62-50-34-16-14-32-48(50)47-31-13-15-33-49(47)61(62)69-63)66(71-65)54-38-22-42-58-60(54)52-36-18-20-40-56(52)68(58,45-27-9-3-10-28-45)46-29-11-4-12-30-46;1-3-15-35(16-4-1)57-45-25-13-11-21-39(45)41-29-27-33(31-47(41)57)53-51-52(56-50-44-24-10-8-20-38(44)37-19-7-9-23-43(37)49(50)55-51)54(59-53)34-28-30-42-40-22-12-14-26-46(40)58(48(42)32-34)36-17-5-2-6-18-36;1-47(2)35-23-11-9-19-31(35)39-33(21-13-25-37(39)47)45-43-44(50-42-30-18-8-6-16-28(30)27-15-5-7-17-29(27)41(42)49-43)46(51-45)34-22-14-26-38-40(34)32-20-10-12-24-36(32)48(38,3)4/h13-46H,1-12H3;5-42H,1-4H3;1-38H;1-42H;1-32H;5-26H,1-4H3.

What are the key properties of 17,19-bis[9,9-bis(4-methoxyphenyl)fluoren-4-yl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9-phenylcarbazol-2-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene?

17,19-bis[9,9-bis(4-methoxyphenyl)fluoren-4-yl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9-phenylcarbazol-2-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene has a molecular weight of 5452.96 g/mol, XLogP of 101.77, 26 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 17,19-bis[9,9-bis(4-methoxyphenyl)fluoren-4-yl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9-phenylcarbazol-2-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene;17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2,4,6,8,10,12,14,16,19-decaene is sourced from PubChem (CID 158339503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).