12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene]

C363H274Cl28N17O26Sb7 — CID 159175381

IUPAC12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene]
SMILESCC(C)(C)c1ccc(N2c3cc(C(C)(C)C)cc4c3[Sb]35(Oc6c(Cl)c(Cl)c(Cl)c(Cl)c6O3)c3c(cc(C(C)(C)C)cc3N(c3ccc(C(C)(C)C)cc3)c3cc(C(C)(C)C)cc2c35)O4)cc1.COc1ccc(N2c3cc(CO)cc4c3[Sb]35(Oc6c(Cl)c(Cl)c(Cl)c(Cl)c6O3)c3c(cc(OC)cc3N(c3ccc(OC)cc3)c3cc(OC)cc2c35)N4c2ccc(CO)cc2)cc1.Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1c4c(cc5ccccc15)Oc1cc5ccccc5c(c1[Sb]341Oc3c(Cl)c(Cl)c(Cl)c(Cl)c3O1)N2c1ccc(C(C)(C)C)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc3c(c2)C(C)(C)c2c-3cc3c4c2Oc2c5c(cc6c2[Sb]42(Oc4c(Cl)c(Cl)c(Cl)c(Cl)c4O2)c2c(cc(C)cc2N6c2ccc(C)cc2)N3c2ccc(C)cc2)-c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc2C5(C)C)cc1.Cc1ccc(N2c3cc(C)cc4c3[Sb]35(Oc6c(Cl)c(Cl)c(Cl)c(Cl)c6O3)c3c(cc(C)cc3N(c3ccc(C)cc3)c3cc(C)cc2c35)O4)cc1.Clc1c(Cl)c(Cl)c2c(c1Cl)O[Sb]13(O2)c2c4cccc2N(c2ccc5ccccc5c2)c2cccc(c21)N(c1ccc2ccccc2c1)c1cccc(c13)O4.Clc1c(Cl)c(Cl)c2c(c1Cl)O[Sb]13(O2)c2c4cccc2N(c2ccccc2)c2cccc(c21)N(c1ccccc1)c1cccc(c13)O4
InChIInChI=1S/C79H67N4O.C50H59N2O.C47H41N2O.C42H36N3O6.C38H23N2O.C35H29N2O.C30H19N2O.7C6H2Cl4O2.7Sb/c1-49-12-24-56(25-13-49)80(57-26-14-50(2)15-27-57)62-36-38-68-70-43-66-47-74(76(70)78(8,9)72(68)45-62)84-75-48-67(83(61-34-22-54(6)23-35-61)65-41-55(7)40-64(42-65)82(66)60-32-20-53(5)21-33-60)44-71-69-39-37-63(46-73(69)79(10,11)77(71)75)81(58-28-16-51(3)17-29-58)59-30-18-52(4)19-31-59;1-46(2,3)33-16-20-38(21-17-33)51-40-24-35(48(7,8)9)25-41(30-40)52(39-22-18-34(19-23-39)47(4,5)6)43-27-37(50(13,14)15)29-45(32-43)53-44-28-36(49(10,11)12)26-42(51)31-44;1-31-24-38-28-39(25-31)49(37-22-18-35(19-23-37)47(5,6)7)45-30-41(27-33-13-9-11-15-43(33)45)50-40-26-32-12-8-10-14-42(32)44(29-40)48(38)36-20-16-34(17-21-36)46(2,3)4;1-48-39-13-9-31(10-14-39)44-34-18-29(27-47)17-33(19-34)43(30-7-5-28(26-46)6-8-30)35-20-37(24-41(22-35)50-3)45(32-11-15-40(49-2)16-12-32)38-21-36(44)23-42(25-38)51-4;1-3-10-29-22-35(20-18-27(29)8-1)39-31-12-5-13-32(24-31)40(36-21-19-28-9-2-4-11-30(28)23-36)34-15-7-17-38(26-34)41-37-16-6-14-33(39)25-37;1-23-6-10-28(11-7-23)36-30-14-25(3)15-31(20-30)37(29-12-8-24(2)9-13-29)33-17-27(5)19-35(22-33)38-34-18-26(4)16-32(36)21-34;1-3-10-23(11-4-1)31-25-14-7-15-26(20-25)32(24-12-5-2-6-13-24)28-17-9-19-30(22-28)33-29-18-8-16-27(31)21-29;7*7-1-2(8)4(10)6(12)5(11)3(1)9;;;;;;;/h12-41,43-46H,1-11H3;16-29H,1-15H3;8-27H,1-7H3;5-18,22-25,46-47H,26-27H2,1-4H3;1-23H;6-19H,1-5H3;1-19H;7*11-12H;;;;;;;/q;;;;;;;;;;;;;;7*+2/p-14
InChIKeyKMFBKNHPNRNAOG-UHFFFAOYSA-A
MW7135.28 g/mol
LogP98.98
Rot. Bonds27

About 12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene]

12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene] (PubChem CID 159175381) has the molecular formula C363H274Cl28N17O26Sb7 and a molecular weight of 7135.28 g/mol. Its IUPAC name is 12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene].

Molecular Properties

Compound Name12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene]
PubChem CID159175381
Molecular FormulaC363H274Cl28N17O26Sb7
Molecular Weight7135.28 g/mol
Exact Mass7111.52
IUPAC Name12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene]
SMILESCC(C)(C)c1ccc(N2c3cc(C(C)(C)C)cc4c3[Sb]35(Oc6c(Cl)c(Cl)c(Cl)c(Cl)c6O3)c3c(cc(C(C)(C)C)cc3N(c3ccc(C(C)(C)C)cc3)c3cc(C(C)(C)C)cc2c35)O4)cc1.COc1ccc(N2c3cc(CO)cc4c3[Sb]35(Oc6c(Cl)c(Cl)c(Cl)c(Cl)c6O3)c3c(cc(OC)cc3N(c3ccc(OC)cc3)c3cc(OC)cc2c35)N4c2ccc(CO)cc2)cc1.Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1c4c(cc5ccccc15)Oc1cc5ccccc5c(c1[Sb]341Oc3c(Cl)c(Cl)c(Cl)c(Cl)c3O1)N2c1ccc(C(C)(C)C)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc3c(c2)C(C)(C)c2c-3cc3c4c2Oc2c5c(cc6c2[Sb]42(Oc4c(Cl)c(Cl)c(Cl)c(Cl)c4O2)c2c(cc(C)cc2N6c2ccc(C)cc2)N3c2ccc(C)cc2)-c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc2C5(C)C)cc1.Cc1ccc(N2c3cc(C)cc4c3[Sb]35(Oc6c(Cl)c(Cl)c(Cl)c(Cl)c6O3)c3c(cc(C)cc3N(c3ccc(C)cc3)c3cc(C)cc2c35)O4)cc1.Clc1c(Cl)c(Cl)c2c(c1Cl)O[Sb]13(O2)c2c4cccc2N(c2ccc5ccccc5c2)c2cccc(c21)N(c1ccc2ccccc2c1)c1cccc(c13)O4.Clc1c(Cl)c(Cl)c2c(c1Cl)O[Sb]13(O2)c2c4cccc2N(c2ccccc2)c2cccc(c21)N(c1ccccc1)c1cccc(c13)O4
InChIInChI=1S/C79H67N4O.C50H59N2O.C47H41N2O.C42H36N3O6.C38H23N2O.C35H29N2O.C30H19N2O.7C6H2Cl4O2.7Sb/c1-49-12-24-56(25-13-49)80(57-26-14-50(2)15-27-57)62-36-38-68-70-43-66-47-74(76(70)78(8,9)72(68)45-62)84-75-48-67(83(61-34-22-54(6)23-35-61)65-41-55(7)40-64(42-65)82(66)60-32-20-53(5)21-33-60)44-71-69-39-37-63(46-73(69)79(10,11)77(71)75)81(58-28-16-51(3)17-29-58)59-30-18-52(4)19-31-59;1-46(2,3)33-16-20-38(21-17-33)51-40-24-35(48(7,8)9)25-41(30-40)52(39-22-18-34(19-23-39)47(4,5)6)43-27-37(50(13,14)15)29-45(32-43)53-44-28-36(49(10,11)12)26-42(51)31-44;1-31-24-38-28-39(25-31)49(37-22-18-35(19-23-37)47(5,6)7)45-30-41(27-33-13-9-11-15-43(33)45)50-40-26-32-12-8-10-14-42(32)44(29-40)48(38)36-20-16-34(17-21-36)46(2,3)4;1-48-39-13-9-31(10-14-39)44-34-18-29(27-47)17-33(19-34)43(30-7-5-28(26-46)6-8-30)35-20-37(24-41(22-35)50-3)45(32-11-15-40(49-2)16-12-32)38-21-36(44)23-42(25-38)51-4;1-3-10-29-22-35(20-18-27(29)8-1)39-31-12-5-13-32(24-31)40(36-21-19-28-9-2-4-11-30(28)23-36)34-15-7-17-38(26-34)41-37-16-6-14-33(39)25-37;1-23-6-10-28(11-7-23)36-30-14-25(3)15-31(20-30)37(29-12-8-24(2)9-13-29)33-17-27(5)19-35(22-33)38-34-18-26(4)16-32(36)21-34;1-3-10-23(11-4-1)31-25-14-7-15-26(20-25)32(24-12-5-2-6-13-24)28-17-9-19-30(22-28)33-29-18-8-16-27(31)21-29;7*7-1-2(8)4(10)6(12)5(11)3(1)9;;;;;;;/h12-41,43-46H,1-11H3;16-29H,1-15H3;8-27H,1-7H3;5-18,22-25,46-47H,26-27H2,1-4H3;1-23H;6-19H,1-5H3;1-19H;7*11-12H;;;;;;;/q;;;;;;;;;;;;;;7*+2/p-14
InChIKeyKMFBKNHPNRNAOG-UHFFFAOYSA-A
XLogP98.98
TPSA317.06 Ų
H-Bond Donors2
H-Bond Acceptors43
Rotatable Bonds27
Heavy Atoms441
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5007135.28
LogP ≤ 598.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1043

Analyze 12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene] with MolForge

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Frequently Asked Questions

What is the IUPAC name of 12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene]?
The IUPAC name of 12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene] (CID 159175381) is 12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene].
What is the SMILES notation for 12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene]?
The canonical SMILES for 12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene] is CC(C)(C)c1ccc(N2c3cc(C(C)(C)C)cc4c3[Sb]35(Oc6c(Cl)c(Cl)c(Cl)c(Cl)c6O3)c3c(cc(C(C)(C)C)cc3N(c3ccc(C(C)(C)C)cc3)c3cc(C(C)(C)C)cc2c35)O4)cc1.COc1ccc(N2c3cc(CO)cc4c3[Sb]35(Oc6c(Cl)c(Cl)c(Cl)c(Cl)c6O3)c3c(cc(OC)cc3N(c3ccc(OC)cc3)c3cc(OC)cc2c35)N4c2ccc(CO)cc2)cc1.Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1c4c(cc5ccccc15)Oc1cc5ccccc5c(c1[Sb]341Oc3c(Cl)c(Cl)c(Cl)c(Cl)c3O1)N2c1ccc(C(C)(C)C)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc3c(c2)C(C)(C)c2c-3cc3c4c2Oc2c5c(cc6c2[Sb]42(Oc4c(Cl)c(Cl)c(Cl)c(Cl)c4O2)c2c(cc(C)cc2N6c2ccc(C)cc2)N3c2ccc(C)cc2)-c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc2C5(C)C)cc1.Cc1ccc(N2c3cc(C)cc4c3[Sb]35(Oc6c(Cl)c(Cl)c(Cl)c(Cl)c6O3)c3c(cc(C)cc3N(c3ccc(C)cc3)c3cc(C)cc2c35)O4)cc1.Clc1c(Cl)c(Cl)c2c(c1Cl)O[Sb]13(O2)c2c4cccc2N(c2ccc5ccccc5c2)c2cccc(c21)N(c1ccc2ccccc2c1)c1cccc(c13)O4.Clc1c(Cl)c(Cl)c2c(c1Cl)O[Sb]13(O2)c2c4cccc2N(c2ccccc2)c2cccc(c21)N(c1ccccc1)c1cccc(c13)O4.
What is the InChIKey of 12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene]?
The InChIKey is KMFBKNHPNRNAOG-UHFFFAOYSA-A. The full InChI is InChI=1S/C79H67N4O.C50H59N2O.C47H41N2O.C42H36N3O6.C38H23N2O.C35H29N2O.C30H19N2O.7C6H2Cl4O2.7Sb/c1-49-12-24-56(25-13-49)80(57-26-14-50(2)15-27-57)62-36-38-68-70-43-66-47-74(76(70)78(8,9)72(68)45-62)84-75-48-67(83(61-34-22-54(6)23-35-61)65-41-55(7)40-64(42-65)82(66)60-32-20-53(5)21-33-60)44-71-69-39-37-63(46-73(69)79(10,11)77(71)75)81(58-28-16-51(3)17-29-58)59-30-18-52(4)19-31-59;1-46(2,3)33-16-20-38(21-17-33)51-40-24-35(48(7,8)9)25-41(30-40)52(39-22-18-34(19-23-39)47(4,5)6)43-27-37(50(13,14)15)29-45(32-43)53-44-28-36(49(10,11)12)26-42(51)31-44;1-31-24-38-28-39(25-31)49(37-22-18-35(19-23-37)47(5,6)7)45-30-41(27-33-13-9-11-15-43(33)45)50-40-26-32-12-8-10-14-42(32)44(29-40)48(38)36-20-16-34(17-21-36)46(2,3)4;1-48-39-13-9-31(10-14-39)44-34-18-29(27-47)17-33(19-34)43(30-7-5-28(26-46)6-8-30)35-20-37(24-41(22-35)50-3)45(32-11-15-40(49-2)16-12-32)38-21-36(44)23-42(25-38)51-4;1-3-10-29-22-35(20-18-27(29)8-1)39-31-12-5-13-32(24-31)40(36-21-19-28-9-2-4-11-30(28)23-36)34-15-7-17-38(26-34)41-37-16-6-14-33(39)25-37;1-23-6-10-28(11-7-23)36-30-14-25(3)15-31(20-30)37(29-12-8-24(2)9-13-29)33-17-27(5)19-35(22-33)38-34-18-26(4)16-32(36)21-34;1-3-10-23(11-4-1)31-25-14-7-15-26(20-25)32(24-12-5-2-6-13-24)28-17-9-19-30(22-28)33-29-18-8-16-27(31)21-29;7*7-1-2(8)4(10)6(12)5(11)3(1)9;;;;;;;/h12-41,43-46H,1-11H3;16-29H,1-15H3;8-27H,1-7H3;5-18,22-25,46-47H,26-27H2,1-4H3;1-23H;6-19H,1-5H3;1-19H;7*11-12H;;;;;;;/q;;;;;;;;;;;;;;7*+2/p-14.
What are the key properties of 12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene]?
12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene] has a molecular weight of 7135.28 g/mol, XLogP of 98.98, 27 rotatable bonds, 2 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for 12',18'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachloro-15'-methylspiro[1,3,2λ5-benzodioxastibole-2,1'-30-oxa-12,18-diaza-1λ5-stibaoctacyclo[15.11.1.13,27.02,11.05,10.013,29.019,28.020,25]triaconta-2(11),3,5,7,9,13,15,17(29),19(28),20,22,24,26-tridecaene];4,5,6,7-tetrachloro-14',22'-dinaphthalen-2-ylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];4,5,6,7-tetrachloro-14',22'-diphenylspiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene];[4-[4,5,6,7-tetrachloro-5'-(hydroxymethyl)-11',17'-dimethoxy-14',22'-bis(4-methoxyphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8,14,22-triaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15,17,19-nonaene]-8'-yl]phenyl]methanol;4,5,6,7-tetrachloro-5',5',18',31',31'-pentamethyl-8-N',8-N',28-N',28-N',15',21'-hexakis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-36-oxa-15,21-diaza-1λ5-stibadecacyclo[18.14.1.13,33.02,14.04,12.06,11.016,35.022,34.024,32.025,30]hexatriaconta-2(14),3,6(11),7,9,12,16,18,20(35),22(34),23,25(30),26,28,32-pentadecaene]-8',28'-diamine;4,5,6,7-tetrachloro-5',11',17'-trimethyl-14',22'-bis(4-methylphenyl)spiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene];5',11',17'-tritert-butyl-14',22'-bis(4-tert-butylphenyl)-4,5,6,7-tetrachlorospiro[1,3,2λ5-benzodioxastibole-2,1'-8-oxa-14,22-diaza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene] is sourced from PubChem (CID 159175381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).