12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine

C348H225B10N23Se7 — CID 161198781

IUPAC12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine
SMILESc1ccc(N(c2ccccc2)c2cc3c4c(c2)N(c2ccccc2)c2c(cc5c6c2c2ccccc2n6-c2cc(N(c6ccccc6)c6ccccc6)cc6c2B5c2ccccc2N6c2ccccc2)B4c2ccccc2[Se]3)cc1.c1ccc(N(c2ccccc2)c2cc3c4c(c2)N(c2ccccc2)c2c(cc5c6c2c2ccccc2n6-c2cc(N(c6ccccc6)c6ccccc6)cc6c2B5c2ccccc2[Se]6)B4c2ccccc2N3c2ccccc2)cc1.c1ccc(N(c2ccccc2)c2cc3c4c(c2)N(c2ccccc2)c2ccccc2B4c2cc4c5c(c2[Se]3)c2ccccc2n5-c2cc(N(c3ccccc3)c3ccccc3)cc3c2B4c2ccccc2N3c2ccccc2)cc1.c1ccc(N(c2ccccc2)c2cc3c4c(c2)N(c2ccccc2)c2ccccc2B4c2cc4c5c(c2[Se]3)c2ccccc2n5-c2cc(N(c3ccccc3)c3ccccc3)cc3c2B4c2ccccc2[Se]3)cc1.c1ccc(N(c2ccccc2)c2cc3c4c(c2)[Se]c2c(cc5c6c2c2ccccc2n6-c2cc(N(c6ccccc6)c6ccccc6)cc6c2B5c2ccccc2N6c2ccccc2)B4c2ccccc2[Se]3)cc1
InChIInChI=1S/3C72H47B2N5Se.2C66H42B2N4Se2/c1-7-25-48(26-8-1)75(49-27-9-2-10-28-49)54-43-63-69-64(44-54)79-61-40-22-19-37-56(61)68-71-59(47-60(72(68)79)73(69)57-38-20-23-41-62(57)77(63)52-33-15-5-16-34-52)74-58-39-21-24-42-66(58)80-67-46-55(45-65(70(67)74)78(71)53-35-17-6-18-36-53)76(50-29-11-3-12-30-50)51-31-13-4-14-32-51;1-7-25-48(26-8-1)75(49-27-9-2-10-28-49)54-43-63-69-64(44-54)78(53-35-17-6-18-36-53)71-59(73(69)57-38-20-23-41-62(57)77(63)52-33-15-5-16-34-52)47-60-72-68(71)56-37-19-22-40-61(56)79(72)65-45-55(46-67-70(65)74(60)58-39-21-24-42-66(58)80-67)76(50-29-11-3-12-30-50)51-31-13-4-14-32-51;1-7-25-48(26-8-1)75(49-27-9-2-10-28-49)54-43-64-69-65(44-54)79-61-40-22-19-37-56(61)68-71(79)59(73(69)57-38-20-23-41-62(57)77(64)52-33-15-5-16-34-52)47-60-72(68)80-67-46-55(76(50-29-11-3-12-30-50)51-31-13-4-14-32-51)45-66-70(67)74(60)58-39-21-24-42-63(58)78(66)53-35-17-6-18-36-53;1-6-22-43(23-7-1)69(44-24-8-2-9-25-44)48-38-57-63-61(41-48)74-66-54(67(63)51-33-17-20-36-56(51)71(57)47-30-14-5-15-31-47)42-53-65-62(66)50-32-16-19-35-55(50)72(65)58-39-49(40-60-64(58)68(53)52-34-18-21-37-59(52)73-60)70(45-26-10-3-11-27-45)46-28-12-4-13-29-46;1-6-22-43(23-7-1)69(44-24-8-2-9-25-44)48-38-57-63-58(39-48)72-55-35-19-16-32-50(55)62-65(72)53(67(63)51-33-17-20-36-56(51)71(57)47-30-14-5-15-31-47)42-54-66(62)74-61-41-49(40-60-64(61)68(54)52-34-18-21-37-59(52)73-60)70(45-26-10-3-11-27-45)46-28-12-4-13-29-46/h3*1-47H;2*1-42H
InChIKeyUURWRJONLQOFFS-UHFFFAOYSA-N
MW5389.63 g/mol
LogP55.39
Rot. Bonds38

About 12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine

12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine (PubChem CID 161198781) has the molecular formula C348H225B10N23Se7 and a molecular weight of 5389.63 g/mol. Its IUPAC name is 12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine.

Molecular Properties

Compound Name12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine
PubChem CID161198781
Molecular FormulaC348H225B10N23Se7
Molecular Weight5389.63 g/mol
Exact Mass5394.34
IUPAC Name12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine
SMILESc1ccc(N(c2ccccc2)c2cc3c4c(c2)N(c2ccccc2)c2c(cc5c6c2c2ccccc2n6-c2cc(N(c6ccccc6)c6ccccc6)cc6c2B5c2ccccc2N6c2ccccc2)B4c2ccccc2[Se]3)cc1.c1ccc(N(c2ccccc2)c2cc3c4c(c2)N(c2ccccc2)c2c(cc5c6c2c2ccccc2n6-c2cc(N(c6ccccc6)c6ccccc6)cc6c2B5c2ccccc2[Se]6)B4c2ccccc2N3c2ccccc2)cc1.c1ccc(N(c2ccccc2)c2cc3c4c(c2)N(c2ccccc2)c2ccccc2B4c2cc4c5c(c2[Se]3)c2ccccc2n5-c2cc(N(c3ccccc3)c3ccccc3)cc3c2B4c2ccccc2N3c2ccccc2)cc1.c1ccc(N(c2ccccc2)c2cc3c4c(c2)N(c2ccccc2)c2ccccc2B4c2cc4c5c(c2[Se]3)c2ccccc2n5-c2cc(N(c3ccccc3)c3ccccc3)cc3c2B4c2ccccc2[Se]3)cc1.c1ccc(N(c2ccccc2)c2cc3c4c(c2)[Se]c2c(cc5c6c2c2ccccc2n6-c2cc(N(c6ccccc6)c6ccccc6)cc6c2B5c2ccccc2N6c2ccccc2)B4c2ccccc2[Se]3)cc1
InChIInChI=1S/3C72H47B2N5Se.2C66H42B2N4Se2/c1-7-25-48(26-8-1)75(49-27-9-2-10-28-49)54-43-63-69-64(44-54)79-61-40-22-19-37-56(61)68-71-59(47-60(72(68)79)73(69)57-38-20-23-41-62(57)77(63)52-33-15-5-16-34-52)74-58-39-21-24-42-66(58)80-67-46-55(45-65(70(67)74)78(71)53-35-17-6-18-36-53)76(50-29-11-3-12-30-50)51-31-13-4-14-32-51;1-7-25-48(26-8-1)75(49-27-9-2-10-28-49)54-43-63-69-64(44-54)78(53-35-17-6-18-36-53)71-59(73(69)57-38-20-23-41-62(57)77(63)52-33-15-5-16-34-52)47-60-72-68(71)56-37-19-22-40-61(56)79(72)65-45-55(46-67-70(65)74(60)58-39-21-24-42-66(58)80-67)76(50-29-11-3-12-30-50)51-31-13-4-14-32-51;1-7-25-48(26-8-1)75(49-27-9-2-10-28-49)54-43-64-69-65(44-54)79-61-40-22-19-37-56(61)68-71(79)59(73(69)57-38-20-23-41-62(57)77(64)52-33-15-5-16-34-52)47-60-72(68)80-67-46-55(76(50-29-11-3-12-30-50)51-31-13-4-14-32-51)45-66-70(67)74(60)58-39-21-24-42-63(58)78(66)53-35-17-6-18-36-53;1-6-22-43(23-7-1)69(44-24-8-2-9-25-44)48-38-57-63-61(41-48)74-66-54(67(63)51-33-17-20-36-56(51)71(57)47-30-14-5-15-31-47)42-53-65-62(66)50-32-16-19-35-55(50)72(65)58-39-49(40-60-64(58)68(53)52-34-18-21-37-59(52)73-60)70(45-26-10-3-11-27-45)46-28-12-4-13-29-46;1-6-22-43(23-7-1)69(44-24-8-2-9-25-44)48-38-57-63-58(39-48)72-55-35-19-16-32-50(55)62-65(72)53(67(63)51-33-17-20-36-56(51)71(57)47-30-14-5-15-31-47)42-54-66(62)74-61-41-49(40-60-64(61)68(54)52-34-18-21-37-59(52)73-60)70(45-26-10-3-11-27-45)46-28-12-4-13-29-46/h3*1-47H;2*1-42H
InChIKeyUURWRJONLQOFFS-UHFFFAOYSA-N
XLogP55.39
TPSA82.97 Ų
H-Bond Donors
H-Bond Acceptors23
Rotatable Bonds38
Heavy Atoms388
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005389.63
LogP ≤ 555.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1023

Analyze 12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine with MolForge

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Related Compounds

12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-thia-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine
CID 156686637
N,N,11,27-tetraphenyl-1,11,27-triaza-20-boranonacyclo[17.13.1.120,28.02,14.04,12.05,10.015,33.021,26.032,34]tetratriaconta-2(14),3,5,7,9,12,15,17,19(33),21,23,25,28,30,32(34)-pentadecaen-30-amine
CID 177260327
20,30-di(carbazol-9-yl)-23,27-diphenyl-17,23,27,33-tetraza-1,5-diboratridecacyclo[26.16.1.15,18.16,10.133,40.02,26.04,24.011,16.032,45.034,39.017,48.022,47.044,46]octatetraconta-2(26),3,6(48),7,9,11,13,15,18(47),19,21,24,28,30,32(45),34,36,38,40,42,44(46)-henicosaene;8,14-diphenyl-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9(21),10,12,15,17,19-nonaene;N,N,8,14-tetraphenyl-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-11-amine
CID 159272798
20-dibenzothiophen-1-yl-15-N,15-N,25-N,25-N,12,28-hexakis-phenyl-18,22-diselena-12,28-diaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2(21),3,6,8,10,13(36),14,16,19,23,25,27(35),29,31,33-pentadecaene-15,25-diamine
CID 164802491
N,N,11,35-tetraphenyl-11,20,26,35-tetraza-1-boratridecacyclo[23.19.1.12,13.126,33.04,12.05,10.014,19.021,45.027,32.034,42.036,41.020,47.044,46]heptatetraconta-2,4(12),5,7,9,13(47),14,16,18,21,23,25(45),27,29,31,33(46),34(42),36,38,40,43-henicosaen-23-amine
CID 170519919
N,N,12,18,35-pentakis-phenyl-31-oxa-22-selena-12,18,35-triaza-1,5-diboraundecacyclo[21.18.1.15,13.02,21.04,19.06,11.024,32.025,30.034,42.036,41.017,43]tritetraconta-2(21),3,6,8,10,13(43),14,16,19,23(42),24(32),25,27,29,33,36,38,40-octadecaen-15-amine
CID 164760130
N,8,14-triphenyl-N-(9-phenylcarbazol-3-yl)-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15,17,19-nonaen-5-amine
CID 140856051
15-N,15-N,20-N,20-N,25-N,25-N,12,28-octakis-phenyl-18-thia-22-selena-12,28-diaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2(21),3,6,8,10,13(36),14,16,19,23,25,27(35),29,31,33-pentadecaene-15,20,25-triamine
CID 164802326
13-N,13-N,19-N,19-N,30-N,30-N,36-N,36-N,16,33-decakis-phenyl-16,22,27,33-tetraza-9,40-diboratridecacyclo[25.17.1.14,8.19,17.128,32.02,26.03,23.010,15.034,39.041,45.021,47.022,48.040,46]octatetraconta-1(44),2(26),3(23),4,6,8(48),10(15),11,13,17,19,21(47),24,28(46),29,31,34(39),35,37,41(45),42-henicosaene-13,19,30,36-tetramine
CID 160798023
20-(2-dibenzothiophen-4-ylphenyl)-15-N,15-N,25-N,25-N,12,28-hexakis-phenyl-18,22-diselena-12,28-diaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2(21),3,6,8,10,13(36),14,16,19,23,25,27(35),29,31,33-pentadecaene-15,25-diamine
CID 164802269
N,N,27-triphenyl-6-oxa-1,27-diaza-20-boranonacyclo[17.13.1.120,28.02,14.05,13.07,12.015,33.021,26.032,34]tetratriaconta-2(14),3,5(13),7,9,11,15,17,19(33),21,23,25,28,30,32(34)-pentadecaen-30-amine
CID 177260349
N,N,12,18,22,28-hexakis-phenyl-12,18,22,28-tetraza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaen-15-amine
CID 159024197

Frequently Asked Questions

What is the IUPAC name of 12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine?
The IUPAC name of 12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine (CID 161198781) is 12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine.
What is the SMILES notation for 12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine?
The canonical SMILES for 12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine is c1ccc(N(c2ccccc2)c2cc3c4c(c2)N(c2ccccc2)c2c(cc5c6c2c2ccccc2n6-c2cc(N(c6ccccc6)c6ccccc6)cc6c2B5c2ccccc2N6c2ccccc2)B4c2ccccc2[Se]3)cc1.c1ccc(N(c2ccccc2)c2cc3c4c(c2)N(c2ccccc2)c2c(cc5c6c2c2ccccc2n6-c2cc(N(c6ccccc6)c6ccccc6)cc6c2B5c2ccccc2[Se]6)B4c2ccccc2N3c2ccccc2)cc1.c1ccc(N(c2ccccc2)c2cc3c4c(c2)N(c2ccccc2)c2ccccc2B4c2cc4c5c(c2[Se]3)c2ccccc2n5-c2cc(N(c3ccccc3)c3ccccc3)cc3c2B4c2ccccc2N3c2ccccc2)cc1.c1ccc(N(c2ccccc2)c2cc3c4c(c2)N(c2ccccc2)c2ccccc2B4c2cc4c5c(c2[Se]3)c2ccccc2n5-c2cc(N(c3ccccc3)c3ccccc3)cc3c2B4c2ccccc2[Se]3)cc1.c1ccc(N(c2ccccc2)c2cc3c4c(c2)[Se]c2c(cc5c6c2c2ccccc2n6-c2cc(N(c6ccccc6)c6ccccc6)cc6c2B5c2ccccc2N6c2ccccc2)B4c2ccccc2[Se]3)cc1.
What is the InChIKey of 12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine?
The InChIKey is UURWRJONLQOFFS-UHFFFAOYSA-N. The full InChI is InChI=1S/3C72H47B2N5Se.2C66H42B2N4Se2/c1-7-25-48(26-8-1)75(49-27-9-2-10-28-49)54-43-63-69-64(44-54)79-61-40-22-19-37-56(61)68-71-59(47-60(72(68)79)73(69)57-38-20-23-41-62(57)77(63)52-33-15-5-16-34-52)74-58-39-21-24-42-66(58)80-67-46-55(45-65(70(67)74)78(71)53-35-17-6-18-36-53)76(50-29-11-3-12-30-50)51-31-13-4-14-32-51;1-7-25-48(26-8-1)75(49-27-9-2-10-28-49)54-43-63-69-64(44-54)78(53-35-17-6-18-36-53)71-59(73(69)57-38-20-23-41-62(57)77(63)52-33-15-5-16-34-52)47-60-72-68(71)56-37-19-22-40-61(56)79(72)65-45-55(46-67-70(65)74(60)58-39-21-24-42-66(58)80-67)76(50-29-11-3-12-30-50)51-31-13-4-14-32-51;1-7-25-48(26-8-1)75(49-27-9-2-10-28-49)54-43-64-69-65(44-54)79-61-40-22-19-37-56(61)68-71(79)59(73(69)57-38-20-23-41-62(57)77(64)52-33-15-5-16-34-52)47-60-72(68)80-67-46-55(76(50-29-11-3-12-30-50)51-31-13-4-14-32-51)45-66-70(67)74(60)58-39-21-24-42-63(58)78(66)53-35-17-6-18-36-53;1-6-22-43(23-7-1)69(44-24-8-2-9-25-44)48-38-57-63-61(41-48)74-66-54(67(63)51-33-17-20-36-56(51)71(57)47-30-14-5-15-31-47)42-53-65-62(66)50-32-16-19-35-55(50)72(65)58-39-49(40-60-64(58)68(53)52-34-18-21-37-59(52)73-60)70(45-26-10-3-11-27-45)46-28-12-4-13-29-46;1-6-22-43(23-7-1)69(44-24-8-2-9-25-44)48-38-57-63-58(39-48)72-55-35-19-16-32-50(55)62-65(72)53(67(63)51-33-17-20-36-56(51)71(57)47-30-14-5-15-31-47)42-54-66(62)74-61-41-49(40-60-64(61)68(54)52-34-18-21-37-59(52)73-60)70(45-26-10-3-11-27-45)46-28-12-4-13-29-46/h3*1-47H;2*1-42H.
What are the key properties of 12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine?
12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine has a molecular weight of 5389.63 g/mol, XLogP of 55.39, 38 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 12-N,12-N,27-N,27-N,9,24-hexakis-phenyl-30-selena-9,15,24-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25(41),26,28,31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-selena-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,24,30-hexakis-phenyl-9-selena-15,24,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,9-pentakis-phenyl-24,30-diselena-9,15-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine;12-N,12-N,27-N,27-N,30-pentakis-phenyl-9,24-diselena-15,30-diaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine is sourced from PubChem (CID 161198781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).