4-(3,5-dimethyl-6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(33,35-dimethyl-8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1-phenyl-1,4-azaborinine;1-phenyl-4-(6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1,4-azaborinine;1-phenyl-4-(8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1,4-azaborinine;1-phenyl-4-(8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1,4-azaborinine;1-phenyl-4-(13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1,4-azaborinine

C352H232B8N48+16 — CID 159449403

About 4-(3,5-dimethyl-6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(33,35-dimethyl-8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1-phenyl-1,4-azaborinine;1-phenyl-4-(6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1,4-azaborinine;1-phenyl-4-(8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1,4-azaborinine;1-phenyl-4-(8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1,4-azaborinine;1-phenyl-4-(13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1,4-azaborinine

4-(3,5-dimethyl-6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(33,35-dimethyl-8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1-phenyl-1,4-azaborinine;1-phenyl-4-(6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1,4-azaborinine;1-phenyl-4-(8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1,4-azaborinine;1-phenyl-4-(8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1,4-azaborinine;1-phenyl-4-(13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1,4-azaborinine (PubChem CID 159449403) has the molecular formula C352H232B8N48+16 and a molecular weight of 5220.56 g/mol. Its IUPAC name is 4-(3,5-dimethyl-6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(33,35-dimethyl-8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1-phenyl-1,4-azaborinine;1-phenyl-4-(6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1,4-azaborinine;1-phenyl-4-(8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1,4-azaborinine;1-phenyl-4-(8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1,4-azaborinine;1-phenyl-4-(13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1,4-azaborinine.

Molecular Properties

• Compound Name: 4-(3,5-dimethyl-6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(33,35-dimethyl-8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1-phenyl-1,4-azaborinine;1-phenyl-4-(6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1,4-azaborinine;1-phenyl-4-(8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1,4-azaborinine;1-phenyl-4-(8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1,4-azaborinine;1-phenyl-4-(13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1,4-azaborinine
• PubChem CID: 159449403
• Molecular Formula: C352H232B8N48+16
• Molecular Weight: 5220.56 g/mol
• Exact Mass: 5218.03
• IUPAC Name: 4-(3,5-dimethyl-6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(33,35-dimethyl-8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1-phenyl-1,4-azaborinine;1-phenyl-4-(6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1,4-azaborinine;1-phenyl-4-(8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1,4-azaborinine;1-phenyl-4-(8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1,4-azaborinine;1-phenyl-4-(13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1,4-azaborinine
• SMILES: C1=CN(c2ccccc2)C=CB1c1cn2[n+](c1)C13c4c(cccc4-2)-n2c4ccccc4c4cc5c6ccccc6n(c5c1c42)-c1cccc[n+]13.C1=CN(c2ccccc2)C=CB1c1cn2[n+](c1)C13c4c(cccc4-2)-n2c4ccccc4c4ccc(c1c42)-n1c2ccccc2c2ccc[n+]3c21.C1=CN(c2ccccc2)C=CB1c1cn2[n+](c1)C13c4c(cccc4-n4c5ccccc5c5ccc[n+]1c54)-n1c4ccccc4c4ccc-2c3c41.C1=CN(c2ccccc2)C=CB1c1cn2[n+](c1)C13c4c-2ccc2c5ccccc5n(c42)-c2ccc4c5ccccc5n(c4c21)-c1cccc[n+]13.Cc1c(B2C=CN(c3ccccc3)C=C2)c(C)[n+]2n1-c1ccc3c4ccccc4n4c3c1C21c2c-4ccc3c4ccccc4n(c23)-c2cccc[n+]21.Cc1c(B2C=CN(c3ccccc3)C=C2)c(C)[n+]2n1-c1ccc3c4ccccc4n4c3c1C21c2c-4cccc2-n2c3ccccc3c3ccc[n+]1c32.Cc1c(B2C=CN(c3ccccc3)C=C2)c(C)[n+]2n1-c1cccc3c1C21c2c(ccc4c5ccccc5n-3c24)-n2c3ccccc3c3ccc[n+]1c32.Cc1c(B2C=CN(c3ccccc3)C=C2)c(C)[n+]2n1-c1cccc3c1C21c2c4c(cc5c6ccccc6n(c25)-c2cccc[n+]21)c1ccccc1n4-3
• InChI: InChI=1S/4C45H31BN6.4C43H27BN6/c1-28-42(46-23-26-47(27-24-46)30-12-4-3-5-13-30)29(2)52-45-40-37(19-10-20-39(40)51(28)52)49-35-17-8-6-14-31(35)33-21-22-38(41(45)43(33)49)50-36-18-9-7-15-32(36)34-16-11-25-48(45)44(34)50;1-28-42(46-23-26-47(27-24-46)30-12-4-3-5-13-30)29(2)52-45-40-37(49-35-17-8-6-14-31(35)33-21-22-39(51(28)52)41(45)43(33)49)19-10-20-38(40)50-36-18-9-7-15-32(36)34-16-11-25-48(45)44(34)50;1-28-42(46-22-25-47(26-23-46)30-13-4-3-5-14-30)29(2)52-45-40-37(19-12-20-38(40)51(28)52)49-35-17-8-6-15-31(35)33-27-34-32-16-7-9-18-36(32)50(44(34)41(45)43(33)49)39-21-10-11-24-48(39)45;1-28-42(46-23-26-47(27-24-46)30-12-4-3-5-13-30)29(2)52-45-40-37(49-35-16-8-6-14-31(35)33-20-22-38(51(28)52)41(45)43(33)49)21-19-34-32-15-7-9-17-36(32)50(44(34)40)39-18-10-11-25-48(39)45;1-2-10-29(11-3-1)45-24-21-44(22-25-45)28-26-47-36-20-19-32-30-12-4-6-15-34(30)49-37-17-8-18-38-39(37)43(48(47)27-28,40(36)41(32)49)46-23-9-14-33-31-13-5-7-16-35(31)50(38)42(33)46;1-2-10-29(11-3-1)45-24-21-44(22-25-45)28-26-47-36-17-8-18-37-39(36)43(48(47)27-28)40-38(20-19-32-30-12-4-6-15-34(30)49(37)41(32)40)50-35-16-7-5-13-31(35)33-14-9-23-46(43)42(33)50;1-2-11-29(12-3-1)45-23-20-44(21-24-45)28-26-47-36-17-10-18-37-39(36)43(48(47)27-28)40-41-32(30-13-4-6-15-34(30)49(37)41)25-33-31-14-5-7-16-35(31)50(42(33)40)38-19-8-9-22-46(38)43;1-2-10-29(11-3-1)45-24-21-44(22-25-45)28-26-47-36-19-17-32-30-12-4-6-14-34(30)49-37-20-18-33-31-13-5-7-15-35(31)50-38-16-8-9-23-46(38)43(48(47)27-28,39(36)41(32)49)40(37)42(33)50/h4*3-27H,1-2H3;4*1-27H/q8*+2
• InChIKey: XQUUPXCMUIIVLV-UHFFFAOYSA-N
• XLogP: 56.96
• TPSA: 206.32 Ų
• H-Bond Acceptors: 32
• Rotatable Bonds: 16
• Heavy Atoms: 408
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5220.56
LogP ≤ 5	56.96
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethyl-6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(33,35-dimethyl-8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1-phenyl-1,4-azaborinine;1-phenyl-4-(6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1,4-azaborinine;1-phenyl-4-(8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1,4-azaborinine;1-phenyl-4-(8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1,4-azaborinine;1-phenyl-4-(13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1,4-azaborinine?

The IUPAC name of 4-(3,5-dimethyl-6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(33,35-dimethyl-8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1-phenyl-1,4-azaborinine;1-phenyl-4-(6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1,4-azaborinine;1-phenyl-4-(8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1,4-azaborinine;1-phenyl-4-(8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1,4-azaborinine;1-phenyl-4-(13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1,4-azaborinine (CID 159449403) is 4-(3,5-dimethyl-6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(33,35-dimethyl-8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1-phenyl-1,4-azaborinine;1-phenyl-4-(6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1,4-azaborinine;1-phenyl-4-(8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1,4-azaborinine;1-phenyl-4-(8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1,4-azaborinine;1-phenyl-4-(13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1,4-azaborinine.

What is the SMILES notation for 4-(3,5-dimethyl-6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(33,35-dimethyl-8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1-phenyl-1,4-azaborinine;1-phenyl-4-(6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1,4-azaborinine;1-phenyl-4-(8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1,4-azaborinine;1-phenyl-4-(8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1,4-azaborinine;1-phenyl-4-(13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1,4-azaborinine?

The canonical SMILES for 4-(3,5-dimethyl-6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(33,35-dimethyl-8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1-phenyl-1,4-azaborinine;1-phenyl-4-(6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1,4-azaborinine;1-phenyl-4-(8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1,4-azaborinine;1-phenyl-4-(8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1,4-azaborinine;1-phenyl-4-(13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1,4-azaborinine is C1=CN(c2ccccc2)C=CB1c1cn2[n+](c1)C13c4c(cccc4-2)-n2c4ccccc4c4cc5c6ccccc6n(c5c1c42)-c1cccc[n+]13.C1=CN(c2ccccc2)C=CB1c1cn2[n+](c1)C13c4c(cccc4-2)-n2c4ccccc4c4ccc(c1c42)-n1c2ccccc2c2ccc[n+]3c21.C1=CN(c2ccccc2)C=CB1c1cn2[n+](c1)C13c4c(cccc4-n4c5ccccc5c5ccc[n+]1c54)-n1c4ccccc4c4ccc-2c3c41.C1=CN(c2ccccc2)C=CB1c1cn2[n+](c1)C13c4c-2ccc2c5ccccc5n(c42)-c2ccc4c5ccccc5n(c4c21)-c1cccc[n+]13.Cc1c(B2C=CN(c3ccccc3)C=C2)c(C)[n+]2n1-c1ccc3c4ccccc4n4c3c1C21c2c-4ccc3c4ccccc4n(c23)-c2cccc[n+]21.Cc1c(B2C=CN(c3ccccc3)C=C2)c(C)[n+]2n1-c1ccc3c4ccccc4n4c3c1C21c2c-4cccc2-n2c3ccccc3c3ccc[n+]1c32.Cc1c(B2C=CN(c3ccccc3)C=C2)c(C)[n+]2n1-c1cccc3c1C21c2c(ccc4c5ccccc5n-3c24)-n2c3ccccc3c3ccc[n+]1c32.Cc1c(B2C=CN(c3ccccc3)C=C2)c(C)[n+]2n1-c1cccc3c1C21c2c4c(cc5c6ccccc6n(c25)-c2cccc[n+]21)c1ccccc1n4-3.

What is the InChIKey of 4-(3,5-dimethyl-6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(33,35-dimethyl-8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1-phenyl-1,4-azaborinine;1-phenyl-4-(6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1,4-azaborinine;1-phenyl-4-(8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1,4-azaborinine;1-phenyl-4-(8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1,4-azaborinine;1-phenyl-4-(13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1,4-azaborinine?

The InChIKey is XQUUPXCMUIIVLV-UHFFFAOYSA-N. The full InChI is InChI=1S/4C45H31BN6.4C43H27BN6/c1-28-42(46-23-26-47(27-24-46)30-12-4-3-5-13-30)29(2)52-45-40-37(19-10-20-39(40)51(28)52)49-35-17-8-6-14-31(35)33-21-22-38(41(45)43(33)49)50-36-18-9-7-15-32(36)34-16-11-25-48(45)44(34)50;1-28-42(46-23-26-47(27-24-46)30-12-4-3-5-13-30)29(2)52-45-40-37(49-35-17-8-6-14-31(35)33-21-22-39(51(28)52)41(45)43(33)49)19-10-20-38(40)50-36-18-9-7-15-32(36)34-16-11-25-48(45)44(34)50;1-28-42(46-22-25-47(26-23-46)30-13-4-3-5-14-30)29(2)52-45-40-37(19-12-20-38(40)51(28)52)49-35-17-8-6-15-31(35)33-27-34-32-16-7-9-18-36(32)50(44(34)41(45)43(33)49)39-21-10-11-24-48(39)45;1-28-42(46-23-26-47(27-24-46)30-12-4-3-5-13-30)29(2)52-45-40-37(49-35-16-8-6-14-31(35)33-20-22-38(51(28)52)41(45)43(33)49)21-19-34-32-15-7-9-17-36(32)50(44(34)40)39-18-10-11-25-48(39)45;1-2-10-29(11-3-1)45-24-21-44(22-25-45)28-26-47-36-20-19-32-30-12-4-6-15-34(30)49-37-17-8-18-38-39(37)43(48(47)27-28,40(36)41(32)49)46-23-9-14-33-31-13-5-7-16-35(31)50(38)42(33)46;1-2-10-29(11-3-1)45-24-21-44(22-25-45)28-26-47-36-17-8-18-37-39(36)43(48(47)27-28)40-38(20-19-32-30-12-4-6-15-34(30)49(37)41(32)40)50-35-16-7-5-13-31(35)33-14-9-23-46(43)42(33)50;1-2-11-29(12-3-1)45-23-20-44(21-24-45)28-26-47-36-17-10-18-37-39(36)43(48(47)27-28)40-41-32(30-13-4-6-15-34(30)49(37)41)25-33-31-14-5-7-16-35(31)50(42(33)40)38-19-8-9-22-46(38)43;1-2-10-29(11-3-1)45-24-21-44(22-25-45)28-26-47-36-19-17-32-30-12-4-6-14-34(30)49-37-20-18-33-31-13-5-7-15-35(31)50-38-16-8-9-23-46(38)43(48(47)27-28,39(36)41(32)49)40(37)42(33)50/h4*3-27H,1-2H3;4*1-27H/q8*+2.

What are the key properties of 4-(3,5-dimethyl-6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(33,35-dimethyl-8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1-phenyl-1,4-azaborinine;1-phenyl-4-(6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1,4-azaborinine;1-phenyl-4-(8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1,4-azaborinine;1-phenyl-4-(8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1,4-azaborinine;1-phenyl-4-(13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1,4-azaborinine?

4-(3,5-dimethyl-6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(33,35-dimethyl-8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1-phenyl-1,4-azaborinine;1-phenyl-4-(6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1,4-azaborinine;1-phenyl-4-(8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1,4-azaborinine;1-phenyl-4-(8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1,4-azaborinine;1-phenyl-4-(13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1,4-azaborinine has a molecular weight of 5220.56 g/mol, XLogP of 56.96, 16 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(3,5-dimethyl-6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(31,33-dimethyl-13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1-phenyl-1,4-azaborinine;4-(33,35-dimethyl-8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1-phenyl-1,4-azaborinine;1-phenyl-4-(6,12,23-triaza-2,34-diazoniaundecacyclo[17.15.2.11,7.123,30.02,6.012,36.013,18.022,35.024,29.011,38.034,37]octatriaconta-2,4,7(38),8,10,13,15,17,19(36),20,22(35),24,26,28,30(37),31,33-heptadecaen-4-yl)-1,4-azaborinine;1-phenyl-4-(8,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.215,18.01,17.02,7.08,16.09,14.020,25.026,36.029,35.030,34]octatriaconta-2,4,6,9,11,13,15,17,20,22,24,26(36),27,29(35),31,33,37-heptadecaen-32-yl)-1,4-azaborinine;1-phenyl-4-(8,26,32-triaza-2,36-diazoniaundecacyclo[25.9.1.115,19.01,17.02,7.08,16.09,14.018,26.020,25.031,37.032,36]octatriaconta-2,4,6,9,11,13,15,17,19(38),20,22,24,27,29,31(37),33,35-heptadecaen-34-yl)-1,4-azaborinine;1-phenyl-4-(13,19,30-triaza-2,34-diazoniaundecacyclo[17.15.2.11,14.12,6.07,12.020,25.026,36.029,35.030,34.013,38.018,37]octatriaconta-2,4,6(38),7,9,11,14,16,18(37),20,22,24,26(36),27,29(35),31,33-heptadecaen-32-yl)-1,4-azaborinine is sourced from PubChem (CID 159449403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).