8,14-diphenyl-1-sulfanylidene-22-triphenylen-2-yl-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;5,5,18,18,31,31-hexamethyl-15,28,43-triphenyl-1-sulfanylidene-15,28,43-triaza-1λ5-phosphadodecacyclo[25.14.1.13,40.02,14.04,12.06,11.016,42.017,25.019,24.029,41.030,38.032,37]tritetraconta-2(14),3,6,8,10,12,16,19,21,23,25,27(42),29,32,34,36,38,40-octadecaene;[4-[5-(hydroxymethyl)-11,17-dimethoxy-14,22-bis(4-methoxyphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaen-8-yl]phenyl]methanol;11-N-(3-methylphenyl)-5-N,5-N,11-N,17-N,17-N,8,14,22-octakis(4-methylphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene-5,11,17-triamine;5,11,17-trimethyl-8,14,22-tris(9,9'-spirobi[fluorene]-2-yl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;11,17,32-triphenyl-4-sulfanylidene-11,17,32-triaza-4λ5-phosphanonacyclo[20.6.2.12,6.14,12.03,18.05,10.019,29.026,30.016,31]dotriaconta-1(29),2,5(10),6,8,12(31),13,15,18,20,22,24,26(30),27-tetradecaene

C376H271N21O6P6S6 — CID 158932198

About 8,14-diphenyl-1-sulfanylidene-22-triphenylen-2-yl-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;5,5,18,18,31,31-hexamethyl-15,28,43-triphenyl-1-sulfanylidene-15,28,43-triaza-1λ5-phosphadodecacyclo[25.14.1.13,40.02,14.04,12.06,11.016,42.017,25.019,24.029,41.030,38.032,37]tritetraconta-2(14),3,6,8,10,12,16,19,21,23,25,27(42),29,32,34,36,38,40-octadecaene;[4-[5-(hydroxymethyl)-11,17-dimethoxy-14,22-bis(4-methoxyphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaen-8-yl]phenyl]methanol;11-N-(3-methylphenyl)-5-N,5-N,11-N,17-N,17-N,8,14,22-octakis(4-methylphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene-5,11,17-triamine;5,11,17-trimethyl-8,14,22-tris(9,9'-spirobi[fluorene]-2-yl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;11,17,32-triphenyl-4-sulfanylidene-11,17,32-triaza-4λ5-phosphanonacyclo[20.6.2.12,6.14,12.03,18.05,10.019,29.026,30.016,31]dotriaconta-1(29),2,5(10),6,8,12(31),13,15,18,20,22,24,26(30),27-tetradecaene

8,14-diphenyl-1-sulfanylidene-22-triphenylen-2-yl-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;5,5,18,18,31,31-hexamethyl-15,28,43-triphenyl-1-sulfanylidene-15,28,43-triaza-1λ5-phosphadodecacyclo[25.14.1.13,40.02,14.04,12.06,11.016,42.017,25.019,24.029,41.030,38.032,37]tritetraconta-2(14),3,6,8,10,12,16,19,21,23,25,27(42),29,32,34,36,38,40-octadecaene;[4-[5-(hydroxymethyl)-11,17-dimethoxy-14,22-bis(4-methoxyphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaen-8-yl]phenyl]methanol;11-N-(3-methylphenyl)-5-N,5-N,11-N,17-N,17-N,8,14,22-octakis(4-methylphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene-5,11,17-triamine;5,11,17-trimethyl-8,14,22-tris(9,9'-spirobi[fluorene]-2-yl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;11,17,32-triphenyl-4-sulfanylidene-11,17,32-triaza-4λ5-phosphanonacyclo[20.6.2.12,6.14,12.03,18.05,10.019,29.026,30.016,31]dotriaconta-1(29),2,5(10),6,8,12(31),13,15,18,20,22,24,26(30),27-tetradecaene (PubChem CID 158932198) has the molecular formula C376H271N21O6P6S6 and a molecular weight of 5557.69 g/mol. Its IUPAC name is 8,14-diphenyl-1-sulfanylidene-22-triphenylen-2-yl-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;5,5,18,18,31,31-hexamethyl-15,28,43-triphenyl-1-sulfanylidene-15,28,43-triaza-1λ5-phosphadodecacyclo[25.14.1.13,40.02,14.04,12.06,11.016,42.017,25.019,24.029,41.030,38.032,37]tritetraconta-2(14),3,6,8,10,12,16,19,21,23,25,27(42),29,32,34,36,38,40-octadecaene;[4-[5-(hydroxymethyl)-11,17-dimethoxy-14,22-bis(4-methoxyphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaen-8-yl]phenyl]methanol;11-N-(3-methylphenyl)-5-N,5-N,11-N,17-N,17-N,8,14,22-octakis(4-methylphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene-5,11,17-triamine;5,11,17-trimethyl-8,14,22-tris(9,9'-spirobi[fluorene]-2-yl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;11,17,32-triphenyl-4-sulfanylidene-11,17,32-triaza-4λ5-phosphanonacyclo[20.6.2.12,6.14,12.03,18.05,10.019,29.026,30.016,31]dotriaconta-1(29),2,5(10),6,8,12(31),13,15,18,20,22,24,26(30),27-tetradecaene.

Molecular Properties

• Compound Name: 8,14-diphenyl-1-sulfanylidene-22-triphenylen-2-yl-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;5,5,18,18,31,31-hexamethyl-15,28,43-triphenyl-1-sulfanylidene-15,28,43-triaza-1λ5-phosphadodecacyclo[25.14.1.13,40.02,14.04,12.06,11.016,42.017,25.019,24.029,41.030,38.032,37]tritetraconta-2(14),3,6,8,10,12,16,19,21,23,25,27(42),29,32,34,36,38,40-octadecaene;[4-[5-(hydroxymethyl)-11,17-dimethoxy-14,22-bis(4-methoxyphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaen-8-yl]phenyl]methanol;11-N-(3-methylphenyl)-5-N,5-N,11-N,17-N,17-N,8,14,22-octakis(4-methylphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene-5,11,17-triamine;5,11,17-trimethyl-8,14,22-tris(9,9'-spirobi[fluorene]-2-yl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;11,17,32-triphenyl-4-sulfanylidene-11,17,32-triaza-4λ5-phosphanonacyclo[20.6.2.12,6.14,12.03,18.05,10.019,29.026,30.016,31]dotriaconta-1(29),2,5(10),6,8,12(31),13,15,18,20,22,24,26(30),27-tetradecaene
• PubChem CID: 158932198
• Molecular Formula: C376H271N21O6P6S6
• Molecular Weight: 5557.69 g/mol
• Exact Mass: 5552.83
• IUPAC Name: 8,14-diphenyl-1-sulfanylidene-22-triphenylen-2-yl-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;5,5,18,18,31,31-hexamethyl-15,28,43-triphenyl-1-sulfanylidene-15,28,43-triaza-1λ5-phosphadodecacyclo[25.14.1.13,40.02,14.04,12.06,11.016,42.017,25.019,24.029,41.030,38.032,37]tritetraconta-2(14),3,6,8,10,12,16,19,21,23,25,27(42),29,32,34,36,38,40-octadecaene;[4-[5-(hydroxymethyl)-11,17-dimethoxy-14,22-bis(4-methoxyphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaen-8-yl]phenyl]methanol;11-N-(3-methylphenyl)-5-N,5-N,11-N,17-N,17-N,8,14,22-octakis(4-methylphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene-5,11,17-triamine;5,11,17-trimethyl-8,14,22-tris(9,9'-spirobi[fluorene]-2-yl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;11,17,32-triphenyl-4-sulfanylidene-11,17,32-triaza-4λ5-phosphanonacyclo[20.6.2.12,6.14,12.03,18.05,10.019,29.026,30.016,31]dotriaconta-1(29),2,5(10),6,8,12(31),13,15,18,20,22,24,26(30),27-tetradecaene
• SMILES: CC1(C)c2ccccc2-c2cc3c4c(c21)N(c1ccccc1)c1cc2c(c5c1P4(=S)c1c(cc4c(c1N3c1ccccc1)C(C)(C)c1ccccc1-4)N5c1ccccc1)C(C)(C)c1ccccc1-2.COc1ccc(N2c3cc(CO)cc4c3P3(=S)c5c(cc(OC)cc5N(c5ccc(OC)cc5)c5cc(OC)cc2c53)N4c2ccc(CO)cc2)cc1.Cc1cc2c3c(c1)N(c1ccc4c(c1)C1(c5ccccc5-c5ccccc51)c1ccccc1-4)c1cc(C)cc4c1P3(=S)c1c(cc(C)cc1N4c1ccc3c(c1)C1(c4ccccc4-c4ccccc41)c1ccccc1-3)N2c1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1ccccc1-2.Cc1ccc(N(c2ccc(C)cc2)c2cc3c4c(c2)N(c2ccc(C)cc2)c2cc(N(c5ccc(C)cc5)c5cccc(C)c5)cc5c2P4(=S)c2c(cc(N(c4ccc(C)cc4)c4ccc(C)cc4)cc2N5c2ccc(C)cc2)N3c2ccc(C)cc2)cc1.S=P12c3c4cccc3N(c3ccccc3)c3c1c(c1ccc5cccc6ccc3c1c65)N(c1ccccc1)c1cccc(c12)N4c1ccccc1.S=P12c3c4cccc3N(c3ccccc3)c3cccc(c31)N(c1ccc3c5ccccc5c5ccccc5c3c1)c1cccc(c12)N4c1ccccc1
• InChI: InChI=1S/C96H60N3PS.C81H69N6PS.C63H48N3PS.C48H30N3PS.C46H28N3PS.C42H36N3O6PS/c1-55-46-85-91-86(47-55)98(59-41-44-71-68-29-11-20-38-80(68)95(83(71)53-59)75-33-15-6-24-63(75)64-25-7-16-34-76(64)95)88-49-57(3)51-90-93(88)100(91,101)92-87(97(85)58-40-43-70-67-28-10-19-37-79(67)94(82(70)52-58)73-31-13-4-22-61(73)62-23-5-14-32-74(62)94)48-56(2)50-89(92)99(90)60-42-45-72-69-30-12-21-39-81(69)96(84(72)54-60)77-35-17-8-26-65(77)66-27-9-18-36-78(66)96;1-52-13-29-61(30-14-52)82(62-31-15-53(2)16-32-62)70-46-73-79-75(48-70)86(67-41-25-58(7)26-42-67)77-50-72(84(65-37-21-56(5)22-38-65)69-12-10-11-60(9)45-69)51-78-81(77)88(79,89)80-74(85(73)66-39-23-57(6)24-40-66)47-71(49-76(80)87(78)68-43-27-59(8)28-44-68)83(63-33-17-54(3)18-34-63)64-35-19-55(4)20-36-64;1-61(2)46-31-19-16-28-40(46)43-34-49-58-55(52(43)61)64(37-22-10-7-11-23-37)50-35-44-41-29-17-20-32-47(41)62(3,4)53(44)56-59(50)67(58,68)60-51(66(56)39-26-14-9-15-27-39)36-45-42-30-18-21-33-48(42)63(5,6)54(45)57(60)65(49)38-24-12-8-13-25-38;53-52-46-40-22-11-23-41(46)50(32-16-5-2-6-17-32)43-25-13-27-45(48(43)52)51(44-26-12-24-42(47(44)52)49(40)31-14-3-1-4-15-31)33-28-29-38-36-20-8-7-18-34(36)35-19-9-10-21-37(35)39(38)30-33;51-50-44-36-21-11-23-38(44)48(32-17-6-2-7-18-32)42-34-27-25-29-13-10-14-30-26-28-35(41(34)40(29)30)43(46(42)50)49(33-19-8-3-9-20-33)39-24-12-22-37(45(39)50)47(36)31-15-4-1-5-16-31;1-48-30-13-9-28(10-14-30)44-35-18-26(24-47)17-34-40(35)52(53)41-36(43(34)27-7-5-25(23-46)6-8-27)19-32(50-3)21-38(41)45(29-11-15-31(49-2)16-12-29)39-22-33(51-4)20-37(44)42(39)52/h4-54H,1-3H3;10-51H,1-9H3;7-36H,1-6H3;1-30H;1-28H;5-22,46-47H,23-24H2,1-4H3
• InChIKey: JJEZAPQLUVFXQI-UHFFFAOYSA-N
• XLogP: 92.19
• TPSA: 145.42 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 33
• Rotatable Bonds: 33
• Heavy Atoms: 415
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5557.69
LogP ≤ 5	92.19
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	33

Frequently Asked Questions

What is the IUPAC name of 8,14-diphenyl-1-sulfanylidene-22-triphenylen-2-yl-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;5,5,18,18,31,31-hexamethyl-15,28,43-triphenyl-1-sulfanylidene-15,28,43-triaza-1λ5-phosphadodecacyclo[25.14.1.13,40.02,14.04,12.06,11.016,42.017,25.019,24.029,41.030,38.032,37]tritetraconta-2(14),3,6,8,10,12,16,19,21,23,25,27(42),29,32,34,36,38,40-octadecaene;[4-[5-(hydroxymethyl)-11,17-dimethoxy-14,22-bis(4-methoxyphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaen-8-yl]phenyl]methanol;11-N-(3-methylphenyl)-5-N,5-N,11-N,17-N,17-N,8,14,22-octakis(4-methylphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene-5,11,17-triamine;5,11,17-trimethyl-8,14,22-tris(9,9'-spirobi[fluorene]-2-yl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;11,17,32-triphenyl-4-sulfanylidene-11,17,32-triaza-4λ5-phosphanonacyclo[20.6.2.12,6.14,12.03,18.05,10.019,29.026,30.016,31]dotriaconta-1(29),2,5(10),6,8,12(31),13,15,18,20,22,24,26(30),27-tetradecaene?

The IUPAC name of 8,14-diphenyl-1-sulfanylidene-22-triphenylen-2-yl-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;5,5,18,18,31,31-hexamethyl-15,28,43-triphenyl-1-sulfanylidene-15,28,43-triaza-1λ5-phosphadodecacyclo[25.14.1.13,40.02,14.04,12.06,11.016,42.017,25.019,24.029,41.030,38.032,37]tritetraconta-2(14),3,6,8,10,12,16,19,21,23,25,27(42),29,32,34,36,38,40-octadecaene;[4-[5-(hydroxymethyl)-11,17-dimethoxy-14,22-bis(4-methoxyphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaen-8-yl]phenyl]methanol;11-N-(3-methylphenyl)-5-N,5-N,11-N,17-N,17-N,8,14,22-octakis(4-methylphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene-5,11,17-triamine;5,11,17-trimethyl-8,14,22-tris(9,9'-spirobi[fluorene]-2-yl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;11,17,32-triphenyl-4-sulfanylidene-11,17,32-triaza-4λ5-phosphanonacyclo[20.6.2.12,6.14,12.03,18.05,10.019,29.026,30.016,31]dotriaconta-1(29),2,5(10),6,8,12(31),13,15,18,20,22,24,26(30),27-tetradecaene (CID 158932198) is 8,14-diphenyl-1-sulfanylidene-22-triphenylen-2-yl-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;5,5,18,18,31,31-hexamethyl-15,28,43-triphenyl-1-sulfanylidene-15,28,43-triaza-1λ5-phosphadodecacyclo[25.14.1.13,40.02,14.04,12.06,11.016,42.017,25.019,24.029,41.030,38.032,37]tritetraconta-2(14),3,6,8,10,12,16,19,21,23,25,27(42),29,32,34,36,38,40-octadecaene;[4-[5-(hydroxymethyl)-11,17-dimethoxy-14,22-bis(4-methoxyphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaen-8-yl]phenyl]methanol;11-N-(3-methylphenyl)-5-N,5-N,11-N,17-N,17-N,8,14,22-octakis(4-methylphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene-5,11,17-triamine;5,11,17-trimethyl-8,14,22-tris(9,9'-spirobi[fluorene]-2-yl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;11,17,32-triphenyl-4-sulfanylidene-11,17,32-triaza-4λ5-phosphanonacyclo[20.6.2.12,6.14,12.03,18.05,10.019,29.026,30.016,31]dotriaconta-1(29),2,5(10),6,8,12(31),13,15,18,20,22,24,26(30),27-tetradecaene.

What is the SMILES notation for 8,14-diphenyl-1-sulfanylidene-22-triphenylen-2-yl-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;5,5,18,18,31,31-hexamethyl-15,28,43-triphenyl-1-sulfanylidene-15,28,43-triaza-1λ5-phosphadodecacyclo[25.14.1.13,40.02,14.04,12.06,11.016,42.017,25.019,24.029,41.030,38.032,37]tritetraconta-2(14),3,6,8,10,12,16,19,21,23,25,27(42),29,32,34,36,38,40-octadecaene;[4-[5-(hydroxymethyl)-11,17-dimethoxy-14,22-bis(4-methoxyphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaen-8-yl]phenyl]methanol;11-N-(3-methylphenyl)-5-N,5-N,11-N,17-N,17-N,8,14,22-octakis(4-methylphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene-5,11,17-triamine;5,11,17-trimethyl-8,14,22-tris(9,9'-spirobi[fluorene]-2-yl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;11,17,32-triphenyl-4-sulfanylidene-11,17,32-triaza-4λ5-phosphanonacyclo[20.6.2.12,6.14,12.03,18.05,10.019,29.026,30.016,31]dotriaconta-1(29),2,5(10),6,8,12(31),13,15,18,20,22,24,26(30),27-tetradecaene?

The canonical SMILES for 8,14-diphenyl-1-sulfanylidene-22-triphenylen-2-yl-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;5,5,18,18,31,31-hexamethyl-15,28,43-triphenyl-1-sulfanylidene-15,28,43-triaza-1λ5-phosphadodecacyclo[25.14.1.13,40.02,14.04,12.06,11.016,42.017,25.019,24.029,41.030,38.032,37]tritetraconta-2(14),3,6,8,10,12,16,19,21,23,25,27(42),29,32,34,36,38,40-octadecaene;[4-[5-(hydroxymethyl)-11,17-dimethoxy-14,22-bis(4-methoxyphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaen-8-yl]phenyl]methanol;11-N-(3-methylphenyl)-5-N,5-N,11-N,17-N,17-N,8,14,22-octakis(4-methylphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene-5,11,17-triamine;5,11,17-trimethyl-8,14,22-tris(9,9'-spirobi[fluorene]-2-yl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;11,17,32-triphenyl-4-sulfanylidene-11,17,32-triaza-4λ5-phosphanonacyclo[20.6.2.12,6.14,12.03,18.05,10.019,29.026,30.016,31]dotriaconta-1(29),2,5(10),6,8,12(31),13,15,18,20,22,24,26(30),27-tetradecaene is CC1(C)c2ccccc2-c2cc3c4c(c21)N(c1ccccc1)c1cc2c(c5c1P4(=S)c1c(cc4c(c1N3c1ccccc1)C(C)(C)c1ccccc1-4)N5c1ccccc1)C(C)(C)c1ccccc1-2.COc1ccc(N2c3cc(CO)cc4c3P3(=S)c5c(cc(OC)cc5N(c5ccc(OC)cc5)c5cc(OC)cc2c53)N4c2ccc(CO)cc2)cc1.Cc1cc2c3c(c1)N(c1ccc4c(c1)C1(c5ccccc5-c5ccccc51)c1ccccc1-4)c1cc(C)cc4c1P3(=S)c1c(cc(C)cc1N4c1ccc3c(c1)C1(c4ccccc4-c4ccccc41)c1ccccc1-3)N2c1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1ccccc1-2.Cc1ccc(N(c2ccc(C)cc2)c2cc3c4c(c2)N(c2ccc(C)cc2)c2cc(N(c5ccc(C)cc5)c5cccc(C)c5)cc5c2P4(=S)c2c(cc(N(c4ccc(C)cc4)c4ccc(C)cc4)cc2N5c2ccc(C)cc2)N3c2ccc(C)cc2)cc1.S=P12c3c4cccc3N(c3ccccc3)c3c1c(c1ccc5cccc6ccc3c1c65)N(c1ccccc1)c1cccc(c12)N4c1ccccc1.S=P12c3c4cccc3N(c3ccccc3)c3cccc(c31)N(c1ccc3c5ccccc5c5ccccc5c3c1)c1cccc(c12)N4c1ccccc1.

What is the InChIKey of 8,14-diphenyl-1-sulfanylidene-22-triphenylen-2-yl-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;5,5,18,18,31,31-hexamethyl-15,28,43-triphenyl-1-sulfanylidene-15,28,43-triaza-1λ5-phosphadodecacyclo[25.14.1.13,40.02,14.04,12.06,11.016,42.017,25.019,24.029,41.030,38.032,37]tritetraconta-2(14),3,6,8,10,12,16,19,21,23,25,27(42),29,32,34,36,38,40-octadecaene;[4-[5-(hydroxymethyl)-11,17-dimethoxy-14,22-bis(4-methoxyphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaen-8-yl]phenyl]methanol;11-N-(3-methylphenyl)-5-N,5-N,11-N,17-N,17-N,8,14,22-octakis(4-methylphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene-5,11,17-triamine;5,11,17-trimethyl-8,14,22-tris(9,9'-spirobi[fluorene]-2-yl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;11,17,32-triphenyl-4-sulfanylidene-11,17,32-triaza-4λ5-phosphanonacyclo[20.6.2.12,6.14,12.03,18.05,10.019,29.026,30.016,31]dotriaconta-1(29),2,5(10),6,8,12(31),13,15,18,20,22,24,26(30),27-tetradecaene?

The InChIKey is JJEZAPQLUVFXQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C96H60N3PS.C81H69N6PS.C63H48N3PS.C48H30N3PS.C46H28N3PS.C42H36N3O6PS/c1-55-46-85-91-86(47-55)98(59-41-44-71-68-29-11-20-38-80(68)95(83(71)53-59)75-33-15-6-24-63(75)64-25-7-16-34-76(64)95)88-49-57(3)51-90-93(88)100(91,101)92-87(97(85)58-40-43-70-67-28-10-19-37-79(67)94(82(70)52-58)73-31-13-4-22-61(73)62-23-5-14-32-74(62)94)48-56(2)50-89(92)99(90)60-42-45-72-69-30-12-21-39-81(69)96(84(72)54-60)77-35-17-8-26-65(77)66-27-9-18-36-78(66)96;1-52-13-29-61(30-14-52)82(62-31-15-53(2)16-32-62)70-46-73-79-75(48-70)86(67-41-25-58(7)26-42-67)77-50-72(84(65-37-21-56(5)22-38-65)69-12-10-11-60(9)45-69)51-78-81(77)88(79,89)80-74(85(73)66-39-23-57(6)24-40-66)47-71(49-76(80)87(78)68-43-27-59(8)28-44-68)83(63-33-17-54(3)18-34-63)64-35-19-55(4)20-36-64;1-61(2)46-31-19-16-28-40(46)43-34-49-58-55(52(43)61)64(37-22-10-7-11-23-37)50-35-44-41-29-17-20-32-47(41)62(3,4)53(44)56-59(50)67(58,68)60-51(66(56)39-26-14-9-15-27-39)36-45-42-30-18-21-33-48(42)63(5,6)54(45)57(60)65(49)38-24-12-8-13-25-38;53-52-46-40-22-11-23-41(46)50(32-16-5-2-6-17-32)43-25-13-27-45(48(43)52)51(44-26-12-24-42(47(44)52)49(40)31-14-3-1-4-15-31)33-28-29-38-36-20-8-7-18-34(36)35-19-9-10-21-37(35)39(38)30-33;51-50-44-36-21-11-23-38(44)48(32-17-6-2-7-18-32)42-34-27-25-29-13-10-14-30-26-28-35(41(34)40(29)30)43(46(42)50)49(33-19-8-3-9-20-33)39-24-12-22-37(45(39)50)47(36)31-15-4-1-5-16-31;1-48-30-13-9-28(10-14-30)44-35-18-26(24-47)17-34-40(35)52(53)41-36(43(34)27-7-5-25(23-46)6-8-27)19-32(50-3)21-38(41)45(29-11-15-31(49-2)16-12-29)39-22-33(51-4)20-37(44)42(39)52/h4-54H,1-3H3;10-51H,1-9H3;7-36H,1-6H3;1-30H;1-28H;5-22,46-47H,23-24H2,1-4H3.

What are the key properties of 8,14-diphenyl-1-sulfanylidene-22-triphenylen-2-yl-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;5,5,18,18,31,31-hexamethyl-15,28,43-triphenyl-1-sulfanylidene-15,28,43-triaza-1λ5-phosphadodecacyclo[25.14.1.13,40.02,14.04,12.06,11.016,42.017,25.019,24.029,41.030,38.032,37]tritetraconta-2(14),3,6,8,10,12,16,19,21,23,25,27(42),29,32,34,36,38,40-octadecaene;[4-[5-(hydroxymethyl)-11,17-dimethoxy-14,22-bis(4-methoxyphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaen-8-yl]phenyl]methanol;11-N-(3-methylphenyl)-5-N,5-N,11-N,17-N,17-N,8,14,22-octakis(4-methylphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene-5,11,17-triamine;5,11,17-trimethyl-8,14,22-tris(9,9'-spirobi[fluorene]-2-yl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;11,17,32-triphenyl-4-sulfanylidene-11,17,32-triaza-4λ5-phosphanonacyclo[20.6.2.12,6.14,12.03,18.05,10.019,29.026,30.016,31]dotriaconta-1(29),2,5(10),6,8,12(31),13,15,18,20,22,24,26(30),27-tetradecaene?

8,14-diphenyl-1-sulfanylidene-22-triphenylen-2-yl-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;5,5,18,18,31,31-hexamethyl-15,28,43-triphenyl-1-sulfanylidene-15,28,43-triaza-1λ5-phosphadodecacyclo[25.14.1.13,40.02,14.04,12.06,11.016,42.017,25.019,24.029,41.030,38.032,37]tritetraconta-2(14),3,6,8,10,12,16,19,21,23,25,27(42),29,32,34,36,38,40-octadecaene;[4-[5-(hydroxymethyl)-11,17-dimethoxy-14,22-bis(4-methoxyphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaen-8-yl]phenyl]methanol;11-N-(3-methylphenyl)-5-N,5-N,11-N,17-N,17-N,8,14,22-octakis(4-methylphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene-5,11,17-triamine;5,11,17-trimethyl-8,14,22-tris(9,9'-spirobi[fluorene]-2-yl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;11,17,32-triphenyl-4-sulfanylidene-11,17,32-triaza-4λ5-phosphanonacyclo[20.6.2.12,6.14,12.03,18.05,10.019,29.026,30.016,31]dotriaconta-1(29),2,5(10),6,8,12(31),13,15,18,20,22,24,26(30),27-tetradecaene has a molecular weight of 5557.69 g/mol, XLogP of 92.19, 33 rotatable bonds, 2 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for 8,14-diphenyl-1-sulfanylidene-22-triphenylen-2-yl-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene;5,5,18,18,31,31-hexamethyl-15,28,43-triphenyl-1-sulfanylidene-15,28,43-triaza-1λ5-phosphadodecacyclo[25.14.1.13,40.02,14.04,12.06,11.016,42.017,25.019,24.029,41.030,38.032,37]tritetraconta-2(14),3,6,8,10,12,16,19,21,23,25,27(42),29,32,34,36,38,40-octadecaene;[4-[5-(hydroxymethyl)-11,17-dimethoxy-14,22-bis(4-methoxyphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaen-8-yl]phenyl]methanol;11-N-(3-methylphenyl)-5-N,5-N,11-N,17-N,17-N,8,14,22-octakis(4-methylphenyl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene-5,11,17-triamine;5,11,17-trimethyl-8,14,22-tris(9,9'-spirobi[fluorene]-2-yl)-1-sulfanylidene-8,14,22-triaza-1λ5-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene;11,17,32-triphenyl-4-sulfanylidene-11,17,32-triaza-4λ5-phosphanonacyclo[20.6.2.12,6.14,12.03,18.05,10.019,29.026,30.016,31]dotriaconta-1(29),2,5(10),6,8,12(31),13,15,18,20,22,24,26(30),27-tetradecaene is sourced from PubChem (CID 158932198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).