6-[[17,19-bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-10-(2-oxochromen-6-yl)oxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaen-5-yl]oxy]chromen-2-one;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-bis(4-propylphenoxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-di(triphenylen-2-yloxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5-(2-methylphenoxy)-10-[2-(trifluoromethyl)phenoxy]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-5,10-dinaphthalen-1-yloxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene

C418H279F3N10O18S5 — CID 159567743

About 6-[[17,19-bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-10-(2-oxochromen-6-yl)oxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaen-5-yl]oxy]chromen-2-one;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-bis(4-propylphenoxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-di(triphenylen-2-yloxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5-(2-methylphenoxy)-10-[2-(trifluoromethyl)phenoxy]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-5,10-dinaphthalen-1-yloxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene

6-[[17,19-bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-10-(2-oxochromen-6-yl)oxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaen-5-yl]oxy]chromen-2-one;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-bis(4-propylphenoxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-di(triphenylen-2-yloxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5-(2-methylphenoxy)-10-[2-(trifluoromethyl)phenoxy]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-5,10-dinaphthalen-1-yloxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene (PubChem CID 159567743) has the molecular formula C418H279F3N10O18S5 and a molecular weight of 5947.21 g/mol. Its IUPAC name is 6-[[17,19-bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-10-(2-oxochromen-6-yl)oxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaen-5-yl]oxy]chromen-2-one;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-bis(4-propylphenoxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-di(triphenylen-2-yloxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5-(2-methylphenoxy)-10-[2-(trifluoromethyl)phenoxy]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-5,10-dinaphthalen-1-yloxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene.

Molecular Properties

• Compound Name: 6-[[17,19-bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-10-(2-oxochromen-6-yl)oxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaen-5-yl]oxy]chromen-2-one;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-bis(4-propylphenoxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-di(triphenylen-2-yloxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5-(2-methylphenoxy)-10-[2-(trifluoromethyl)phenoxy]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-5,10-dinaphthalen-1-yloxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene
• PubChem CID: 159567743
• Molecular Formula: C418H279F3N10O18S5
• Molecular Weight: 5947.21 g/mol
• Exact Mass: 5941.98
• IUPAC Name: 6-[[17,19-bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-10-(2-oxochromen-6-yl)oxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaen-5-yl]oxy]chromen-2-one;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-bis(4-propylphenoxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-di(triphenylen-2-yloxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5-(2-methylphenoxy)-10-[2-(trifluoromethyl)phenoxy]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-5,10-dinaphthalen-1-yloxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene
• SMILES: C=Cc1ccc(Oc2ccc(C3(c4ccc(Oc5ccc(C=C)cc5)cc4)c4ccccc4-c4c(-c5sc(-c6cccc7c6-c6ccccc6C7(c6ccc(Oc7ccc(C=C)cc7)cc6)c6ccc(Oc7ccc(C=C)cc7)cc6)c6nc7c8ccc(Oc9ccc%10oc(=O)ccc%10c9)cc8c8cc(Oc9ccc%10oc(=O)ccc%10c9)ccc8c7nc56)cccc43)cc2)cc1.CC1(C)c2ccccc2-c2c(-c3sc(-c4cccc5c4-c4ccccc4C5(C)C)c4nc5c6ccc(Oc7ccc8c9ccccc9c9ccccc9c8c7)cc6c6cc(Oc7ccc8c9ccccc9c9ccccc9c8c7)ccc6c5nc34)cccc21.CCCc1ccc(Oc2ccc3c(c2)c2cc(Oc4ccc(CCC)cc4)ccc2c2nc4c(-c5cccc6c5-c5ccccc5C6(C)C)sc(-c5cccc6c5-c5ccccc5C6(C)C)c4nc32)cc1.Cc1ccccc1Oc1ccc2c(c1)c1cc(Oc3ccccc3C(F)(F)F)ccc1c1nc3c(-c4cccc5c4-c4ccccc4C5(C)C)sc(-c4cccc5c4-c4ccccc4C5(C)C)c3nc21.c1ccc(C2(c3ccccc3)c3ccccc3-c3c(-c4sc(-c5cccc6c5-c5ccccc5C6(c5ccccc5)c5ccccc5)c5nc6c7ccc(Oc8cccc9ccccc89)cc7c7cc(Oc8cccc9ccccc89)ccc7c6nc45)cccc32)cc1
• InChI: InChI=1S/C118H74N2O10S.C88H54N2O2S.C84H54N2O2S.C66H54N2O2S.C62H43F3N2O2S/c1-5-71-23-41-81(42-24-71)123-85-49-33-77(34-50-85)117(78-35-51-86(52-36-78)124-82-43-25-72(6-2)26-44-82)101-19-11-9-15-95(101)109-97(17-13-21-103(109)117)115-113-114(120-112-94-62-58-92(128-90-60-64-106-76(68-90)32-66-108(122)130-106)70-100(94)99-69-91(57-61-93(99)111(112)119-113)127-89-59-63-105-75(67-89)31-65-107(121)129-105)116(131-115)98-18-14-22-104-110(98)96-16-10-12-20-102(96)118(104,79-37-53-87(54-38-79)125-83-45-27-73(7-3)28-46-83)80-39-55-88(56-40-80)126-84-47-29-74(8-4)30-48-84;1-5-29-57(30-6-1)87(58-31-7-2-8-32-58)73-43-19-17-39-67(73)79-69(41-23-45-75(79)87)85-83-84(86(93-85)70-42-24-46-76-80(70)68-40-18-20-44-74(68)88(76,59-33-9-3-10-34-59)60-35-11-4-12-36-60)90-82-66-52-50-62(92-78-48-22-28-56-26-14-16-38-64(56)78)54-72(66)71-53-61(49-51-65(71)81(82)89-83)91-77-47-21-27-55-25-13-15-37-63(55)77;1-83(2)71-31-15-13-27-63(71)75-65(29-17-33-73(75)83)81-79-80(82(89-81)66-30-18-34-74-76(66)64-28-14-16-32-72(64)84(74,3)4)86-78-62-42-38-50(88-48-36-40-60-56-24-8-6-20-52(56)54-22-10-12-26-58(54)68(60)44-48)46-70(62)69-45-49(37-41-61(69)77(78)85-79)87-47-35-39-59-55-23-7-5-19-51(55)53-21-9-11-25-57(53)67(59)43-47;1-7-15-39-25-29-41(30-26-39)69-43-33-35-45-51(37-43)52-38-44(70-42-31-27-40(16-8-2)28-32-42)34-36-46(52)60-59(45)67-61-62(68-60)64(50-20-14-24-56-58(50)48-18-10-12-22-54(48)66(56,5)6)71-63(61)49-19-13-23-55-57(49)47-17-9-11-21-53(47)65(55,3)4;1-34-16-6-12-26-50(34)68-35-28-30-37-43(32-35)44-33-36(69-51-27-13-11-23-47(51)62(63,64)65)29-31-38(44)55-54(37)66-56-57(67-55)59(42-20-15-25-49-53(42)40-18-8-10-22-46(40)61(49,4)5)70-58(56)41-19-14-24-48-52(41)39-17-7-9-21-45(39)60(48,2)3/h5-70H,1-4H2;1-54H;5-46H,1-4H3;9-14,17-38H,7-8,15-16H2,1-6H3;6-33H,1-5H3
• InChIKey: MHKLFUUMLGOXPL-UHFFFAOYSA-N
• XLogP: 114.05
• TPSA: 318.54 Ų
• H-Bond Acceptors: 33
• Rotatable Bonds: 54
• Heavy Atoms: 454
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5947.21
LogP ≤ 5	114.05
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	33

Frequently Asked Questions

What is the IUPAC name of 6-[[17,19-bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-10-(2-oxochromen-6-yl)oxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaen-5-yl]oxy]chromen-2-one;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-bis(4-propylphenoxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-di(triphenylen-2-yloxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5-(2-methylphenoxy)-10-[2-(trifluoromethyl)phenoxy]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-5,10-dinaphthalen-1-yloxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene?

The IUPAC name of 6-[[17,19-bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-10-(2-oxochromen-6-yl)oxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaen-5-yl]oxy]chromen-2-one;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-bis(4-propylphenoxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-di(triphenylen-2-yloxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5-(2-methylphenoxy)-10-[2-(trifluoromethyl)phenoxy]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-5,10-dinaphthalen-1-yloxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene (CID 159567743) is 6-[[17,19-bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-10-(2-oxochromen-6-yl)oxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaen-5-yl]oxy]chromen-2-one;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-bis(4-propylphenoxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-di(triphenylen-2-yloxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5-(2-methylphenoxy)-10-[2-(trifluoromethyl)phenoxy]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-5,10-dinaphthalen-1-yloxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene.

What is the SMILES notation for 6-[[17,19-bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-10-(2-oxochromen-6-yl)oxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaen-5-yl]oxy]chromen-2-one;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-bis(4-propylphenoxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-di(triphenylen-2-yloxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5-(2-methylphenoxy)-10-[2-(trifluoromethyl)phenoxy]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-5,10-dinaphthalen-1-yloxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene?

The canonical SMILES for 6-[[17,19-bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-10-(2-oxochromen-6-yl)oxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaen-5-yl]oxy]chromen-2-one;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-bis(4-propylphenoxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-di(triphenylen-2-yloxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5-(2-methylphenoxy)-10-[2-(trifluoromethyl)phenoxy]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-5,10-dinaphthalen-1-yloxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene is C=Cc1ccc(Oc2ccc(C3(c4ccc(Oc5ccc(C=C)cc5)cc4)c4ccccc4-c4c(-c5sc(-c6cccc7c6-c6ccccc6C7(c6ccc(Oc7ccc(C=C)cc7)cc6)c6ccc(Oc7ccc(C=C)cc7)cc6)c6nc7c8ccc(Oc9ccc%10oc(=O)ccc%10c9)cc8c8cc(Oc9ccc%10oc(=O)ccc%10c9)ccc8c7nc56)cccc43)cc2)cc1.CC1(C)c2ccccc2-c2c(-c3sc(-c4cccc5c4-c4ccccc4C5(C)C)c4nc5c6ccc(Oc7ccc8c9ccccc9c9ccccc9c8c7)cc6c6cc(Oc7ccc8c9ccccc9c9ccccc9c8c7)ccc6c5nc34)cccc21.CCCc1ccc(Oc2ccc3c(c2)c2cc(Oc4ccc(CCC)cc4)ccc2c2nc4c(-c5cccc6c5-c5ccccc5C6(C)C)sc(-c5cccc6c5-c5ccccc5C6(C)C)c4nc32)cc1.Cc1ccccc1Oc1ccc2c(c1)c1cc(Oc3ccccc3C(F)(F)F)ccc1c1nc3c(-c4cccc5c4-c4ccccc4C5(C)C)sc(-c4cccc5c4-c4ccccc4C5(C)C)c3nc21.c1ccc(C2(c3ccccc3)c3ccccc3-c3c(-c4sc(-c5cccc6c5-c5ccccc5C6(c5ccccc5)c5ccccc5)c5nc6c7ccc(Oc8cccc9ccccc89)cc7c7cc(Oc8cccc9ccccc89)ccc7c6nc45)cccc32)cc1.

What is the InChIKey of 6-[[17,19-bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-10-(2-oxochromen-6-yl)oxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaen-5-yl]oxy]chromen-2-one;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-bis(4-propylphenoxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-di(triphenylen-2-yloxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5-(2-methylphenoxy)-10-[2-(trifluoromethyl)phenoxy]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-5,10-dinaphthalen-1-yloxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene?

The InChIKey is MHKLFUUMLGOXPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C118H74N2O10S.C88H54N2O2S.C84H54N2O2S.C66H54N2O2S.C62H43F3N2O2S/c1-5-71-23-41-81(42-24-71)123-85-49-33-77(34-50-85)117(78-35-51-86(52-36-78)124-82-43-25-72(6-2)26-44-82)101-19-11-9-15-95(101)109-97(17-13-21-103(109)117)115-113-114(120-112-94-62-58-92(128-90-60-64-106-76(68-90)32-66-108(122)130-106)70-100(94)99-69-91(57-61-93(99)111(112)119-113)127-89-59-63-105-75(67-89)31-65-107(121)129-105)116(131-115)98-18-14-22-104-110(98)96-16-10-12-20-102(96)118(104,79-37-53-87(54-38-79)125-83-45-27-73(7-3)28-46-83)80-39-55-88(56-40-80)126-84-47-29-74(8-4)30-48-84;1-5-29-57(30-6-1)87(58-31-7-2-8-32-58)73-43-19-17-39-67(73)79-69(41-23-45-75(79)87)85-83-84(86(93-85)70-42-24-46-76-80(70)68-40-18-20-44-74(68)88(76,59-33-9-3-10-34-59)60-35-11-4-12-36-60)90-82-66-52-50-62(92-78-48-22-28-56-26-14-16-38-64(56)78)54-72(66)71-53-61(49-51-65(71)81(82)89-83)91-77-47-21-27-55-25-13-15-37-63(55)77;1-83(2)71-31-15-13-27-63(71)75-65(29-17-33-73(75)83)81-79-80(82(89-81)66-30-18-34-74-76(66)64-28-14-16-32-72(64)84(74,3)4)86-78-62-42-38-50(88-48-36-40-60-56-24-8-6-20-52(56)54-22-10-12-26-58(54)68(60)44-48)46-70(62)69-45-49(37-41-61(69)77(78)85-79)87-47-35-39-59-55-23-7-5-19-51(55)53-21-9-11-25-57(53)67(59)43-47;1-7-15-39-25-29-41(30-26-39)69-43-33-35-45-51(37-43)52-38-44(70-42-31-27-40(16-8-2)28-32-42)34-36-46(52)60-59(45)67-61-62(68-60)64(50-20-14-24-56-58(50)48-18-10-12-22-54(48)66(56,5)6)71-63(61)49-19-13-23-55-57(49)47-17-9-11-21-53(47)65(55,3)4;1-34-16-6-12-26-50(34)68-35-28-30-37-43(32-35)44-33-36(69-51-27-13-11-23-47(51)62(63,64)65)29-31-38(44)55-54(37)66-56-57(67-55)59(42-20-15-25-49-53(42)40-18-8-10-22-46(40)61(49,4)5)70-58(56)41-19-14-24-48-52(41)39-17-7-9-21-45(39)60(48,2)3/h5-70H,1-4H2;1-54H;5-46H,1-4H3;9-14,17-38H,7-8,15-16H2,1-6H3;6-33H,1-5H3.

What are the key properties of 6-[[17,19-bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-10-(2-oxochromen-6-yl)oxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaen-5-yl]oxy]chromen-2-one;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-bis(4-propylphenoxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-di(triphenylen-2-yloxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5-(2-methylphenoxy)-10-[2-(trifluoromethyl)phenoxy]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-5,10-dinaphthalen-1-yloxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene?

6-[[17,19-bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-10-(2-oxochromen-6-yl)oxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaen-5-yl]oxy]chromen-2-one;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-bis(4-propylphenoxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-di(triphenylen-2-yloxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5-(2-methylphenoxy)-10-[2-(trifluoromethyl)phenoxy]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-5,10-dinaphthalen-1-yloxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene has a molecular weight of 5947.21 g/mol, XLogP of 114.05, 54 rotatable bonds, 0 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[[17,19-bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-10-(2-oxochromen-6-yl)oxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaen-5-yl]oxy]chromen-2-one;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-bis(4-propylphenoxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5,10-di(triphenylen-2-yloxy)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-5-(2-methylphenoxy)-10-[2-(trifluoromethyl)phenoxy]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-diphenylfluoren-4-yl)-5,10-dinaphthalen-1-yloxy-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene is sourced from PubChem (CID 159567743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).