13,34-bis(2,6-dimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5,7,9,11,14(44),15,17,19,21,24,26,28,30,32,35(43),36,38,40-icosaene;13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),11,14(44),15,17,19,21,24,26(31),32,35(43),36,38,40-hexadecaene;8,29-dicyclopentyl-13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),6,8,11,14(44),15,17,19,21,24,26(31),27,29,32,35(43),36,38,40-icosaene;9-(2,6-dimethylphenyl)-6-phenyl-26-(2,4,6-trimethylphenyl)-2,19-diaza-9,26-diboranonacyclo[17.15.1.12,10.03,8.011,16.020,25.027,35.028,33.018,36]hexatriaconta-1(34),3(8),4,6,10(36),11,13,15,17,20,22,24,27(35),28,30,32-hexadecaene

C237H194B8N8 — CID 158560751

About 13,34-bis(2,6-dimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5,7,9,11,14(44),15,17,19,21,24,26,28,30,32,35(43),36,38,40-icosaene;13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),11,14(44),15,17,19,21,24,26(31),32,35(43),36,38,40-hexadecaene;8,29-dicyclopentyl-13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),6,8,11,14(44),15,17,19,21,24,26(31),27,29,32,35(43),36,38,40-icosaene;9-(2,6-dimethylphenyl)-6-phenyl-26-(2,4,6-trimethylphenyl)-2,19-diaza-9,26-diboranonacyclo[17.15.1.12,10.03,8.011,16.020,25.027,35.028,33.018,36]hexatriaconta-1(34),3(8),4,6,10(36),11,13,15,17,20,22,24,27(35),28,30,32-hexadecaene

13,34-bis(2,6-dimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5,7,9,11,14(44),15,17,19,21,24,26,28,30,32,35(43),36,38,40-icosaene;13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),11,14(44),15,17,19,21,24,26(31),32,35(43),36,38,40-hexadecaene;8,29-dicyclopentyl-13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),6,8,11,14(44),15,17,19,21,24,26(31),27,29,32,35(43),36,38,40-icosaene;9-(2,6-dimethylphenyl)-6-phenyl-26-(2,4,6-trimethylphenyl)-2,19-diaza-9,26-diboranonacyclo[17.15.1.12,10.03,8.011,16.020,25.027,35.028,33.018,36]hexatriaconta-1(34),3(8),4,6,10(36),11,13,15,17,20,22,24,27(35),28,30,32-hexadecaene (PubChem CID 158560751) has the molecular formula C237H194B8N8 and a molecular weight of 3240.71 g/mol. Its IUPAC name is 13,34-bis(2,6-dimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5,7,9,11,14(44),15,17,19,21,24,26,28,30,32,35(43),36,38,40-icosaene;13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),11,14(44),15,17,19,21,24,26(31),32,35(43),36,38,40-hexadecaene;8,29-dicyclopentyl-13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),6,8,11,14(44),15,17,19,21,24,26(31),27,29,32,35(43),36,38,40-icosaene;9-(2,6-dimethylphenyl)-6-phenyl-26-(2,4,6-trimethylphenyl)-2,19-diaza-9,26-diboranonacyclo[17.15.1.12,10.03,8.011,16.020,25.027,35.028,33.018,36]hexatriaconta-1(34),3(8),4,6,10(36),11,13,15,17,20,22,24,27(35),28,30,32-hexadecaene.

Molecular Properties

• Compound Name: 13,34-bis(2,6-dimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5,7,9,11,14(44),15,17,19,21,24,26,28,30,32,35(43),36,38,40-icosaene;13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),11,14(44),15,17,19,21,24,26(31),32,35(43),36,38,40-hexadecaene;8,29-dicyclopentyl-13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),6,8,11,14(44),15,17,19,21,24,26(31),27,29,32,35(43),36,38,40-icosaene;9-(2,6-dimethylphenyl)-6-phenyl-26-(2,4,6-trimethylphenyl)-2,19-diaza-9,26-diboranonacyclo[17.15.1.12,10.03,8.011,16.020,25.027,35.028,33.018,36]hexatriaconta-1(34),3(8),4,6,10(36),11,13,15,17,20,22,24,27(35),28,30,32-hexadecaene
• PubChem CID: 158560751
• Molecular Formula: C237H194B8N8
• Molecular Weight: 3240.71 g/mol
• Exact Mass: 3239.62
• IUPAC Name: 13,34-bis(2,6-dimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5,7,9,11,14(44),15,17,19,21,24,26,28,30,32,35(43),36,38,40-icosaene;13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),11,14(44),15,17,19,21,24,26(31),32,35(43),36,38,40-hexadecaene;8,29-dicyclopentyl-13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),6,8,11,14(44),15,17,19,21,24,26(31),27,29,32,35(43),36,38,40-icosaene;9-(2,6-dimethylphenyl)-6-phenyl-26-(2,4,6-trimethylphenyl)-2,19-diaza-9,26-diboranonacyclo[17.15.1.12,10.03,8.011,16.020,25.027,35.028,33.018,36]hexatriaconta-1(34),3(8),4,6,10(36),11,13,15,17,20,22,24,27(35),28,30,32-hexadecaene
• SMILES: Cc1cc(C)c(B2c3cc4c(cc3N3c5cc6ccccc6c6c5N(c5cc7c(cc5B6c5c(C)cc(C)cc5C)CCCC7)c5cc6ccccc6c2c53)CCCC4)c(C)c1.Cc1cc(C)c(B2c3cc4cc(C5CCCC5)ccc4cc3N3c4cc5ccccc5c5c4N(c4cc6ccc(C7CCCC7)cc6cc4B5c4c(C)cc(C)cc4C)c4cc5ccccc5c2c43)c(C)c1.Cc1cc(C)c(B2c3ccccc3N3c4cc5ccccc5c5c4N(c4ccc(-c6ccccc6)cc4B5c4c(C)cccc4C)c4cc5ccccc5c2c43)c(C)c1.Cc1cccc(C)c1B1c2cc3ccccc3cc2N2c3cc4ccccc4c4c3N(c3cc5ccccc5cc3B4c3c(C)cccc3C)c3cc4ccccc4c1c32
• InChI: InChI=1S/C68H60B2N2.C58H52B2N2.C56H40B2N2.C55H42B2N2/c1-39-27-41(3)63(42(4)28-39)69-57-33-53-31-47(45-15-7-8-16-45)23-25-49(53)35-59(57)71-62-38-52-20-12-14-22-56(52)66-68(62)72(61-37-51-19-11-13-21-55(51)65(69)67(61)71)60-36-50-26-24-48(46-17-9-10-18-46)32-54(50)34-58(60)70(66)64-43(5)29-40(2)30-44(64)6;1-33-23-35(3)53(36(4)24-33)59-47-27-39-15-7-9-17-41(39)29-49(47)61-52-32-44-20-12-14-22-46(44)56-58(52)62(51-31-43-19-11-13-21-45(43)55(59)57(51)61)50-30-42-18-10-8-16-40(42)28-48(50)60(56)54-37(5)25-34(2)26-38(54)6;1-33-15-13-16-34(2)51(33)57-45-27-37-19-5-7-21-39(37)29-47(45)59-50-32-42-24-10-12-26-44(42)54-56(50)60(49-31-41-23-9-11-25-43(41)53(57)55(49)59)48-30-40-22-8-6-20-38(40)28-46(48)58(54)52-35(3)17-14-18-36(52)4;1-33-28-36(4)51(37(5)29-33)56-44-24-13-14-25-46(44)58-48-31-41-21-10-12-23-43(41)53-55(48)59(49-32-40-20-9-11-22-42(40)52(56)54(49)58)47-27-26-39(38-18-7-6-8-19-38)30-45(47)57(53)50-34(2)16-15-17-35(50)3/h11-14,19-38,45-46H,7-10,15-18H2,1-6H3;11-14,19-32H,7-10,15-18H2,1-6H3;5-32H,1-4H3;6-32H,1-5H3
• InChIKey: HQVWTPUOKSZCGI-UHFFFAOYSA-N
• XLogP: 45.45
• TPSA: 25.92 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 11
• Heavy Atoms: 253
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	3240.71
LogP ≤ 5	45.45
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 13,34-bis(2,6-dimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5,7,9,11,14(44),15,17,19,21,24,26,28,30,32,35(43),36,38,40-icosaene;13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),11,14(44),15,17,19,21,24,26(31),32,35(43),36,38,40-hexadecaene;8,29-dicyclopentyl-13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),6,8,11,14(44),15,17,19,21,24,26(31),27,29,32,35(43),36,38,40-icosaene;9-(2,6-dimethylphenyl)-6-phenyl-26-(2,4,6-trimethylphenyl)-2,19-diaza-9,26-diboranonacyclo[17.15.1.12,10.03,8.011,16.020,25.027,35.028,33.018,36]hexatriaconta-1(34),3(8),4,6,10(36),11,13,15,17,20,22,24,27(35),28,30,32-hexadecaene?

The IUPAC name of 13,34-bis(2,6-dimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5,7,9,11,14(44),15,17,19,21,24,26,28,30,32,35(43),36,38,40-icosaene;13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),11,14(44),15,17,19,21,24,26(31),32,35(43),36,38,40-hexadecaene;8,29-dicyclopentyl-13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),6,8,11,14(44),15,17,19,21,24,26(31),27,29,32,35(43),36,38,40-icosaene;9-(2,6-dimethylphenyl)-6-phenyl-26-(2,4,6-trimethylphenyl)-2,19-diaza-9,26-diboranonacyclo[17.15.1.12,10.03,8.011,16.020,25.027,35.028,33.018,36]hexatriaconta-1(34),3(8),4,6,10(36),11,13,15,17,20,22,24,27(35),28,30,32-hexadecaene (CID 158560751) is 13,34-bis(2,6-dimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5,7,9,11,14(44),15,17,19,21,24,26,28,30,32,35(43),36,38,40-icosaene;13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),11,14(44),15,17,19,21,24,26(31),32,35(43),36,38,40-hexadecaene;8,29-dicyclopentyl-13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),6,8,11,14(44),15,17,19,21,24,26(31),27,29,32,35(43),36,38,40-icosaene;9-(2,6-dimethylphenyl)-6-phenyl-26-(2,4,6-trimethylphenyl)-2,19-diaza-9,26-diboranonacyclo[17.15.1.12,10.03,8.011,16.020,25.027,35.028,33.018,36]hexatriaconta-1(34),3(8),4,6,10(36),11,13,15,17,20,22,24,27(35),28,30,32-hexadecaene.

What is the SMILES notation for 13,34-bis(2,6-dimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5,7,9,11,14(44),15,17,19,21,24,26,28,30,32,35(43),36,38,40-icosaene;13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),11,14(44),15,17,19,21,24,26(31),32,35(43),36,38,40-hexadecaene;8,29-dicyclopentyl-13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),6,8,11,14(44),15,17,19,21,24,26(31),27,29,32,35(43),36,38,40-icosaene;9-(2,6-dimethylphenyl)-6-phenyl-26-(2,4,6-trimethylphenyl)-2,19-diaza-9,26-diboranonacyclo[17.15.1.12,10.03,8.011,16.020,25.027,35.028,33.018,36]hexatriaconta-1(34),3(8),4,6,10(36),11,13,15,17,20,22,24,27(35),28,30,32-hexadecaene?

The canonical SMILES for 13,34-bis(2,6-dimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5,7,9,11,14(44),15,17,19,21,24,26,28,30,32,35(43),36,38,40-icosaene;13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),11,14(44),15,17,19,21,24,26(31),32,35(43),36,38,40-hexadecaene;8,29-dicyclopentyl-13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),6,8,11,14(44),15,17,19,21,24,26(31),27,29,32,35(43),36,38,40-icosaene;9-(2,6-dimethylphenyl)-6-phenyl-26-(2,4,6-trimethylphenyl)-2,19-diaza-9,26-diboranonacyclo[17.15.1.12,10.03,8.011,16.020,25.027,35.028,33.018,36]hexatriaconta-1(34),3(8),4,6,10(36),11,13,15,17,20,22,24,27(35),28,30,32-hexadecaene is Cc1cc(C)c(B2c3cc4c(cc3N3c5cc6ccccc6c6c5N(c5cc7c(cc5B6c5c(C)cc(C)cc5C)CCCC7)c5cc6ccccc6c2c53)CCCC4)c(C)c1.Cc1cc(C)c(B2c3cc4cc(C5CCCC5)ccc4cc3N3c4cc5ccccc5c5c4N(c4cc6ccc(C7CCCC7)cc6cc4B5c4c(C)cc(C)cc4C)c4cc5ccccc5c2c43)c(C)c1.Cc1cc(C)c(B2c3ccccc3N3c4cc5ccccc5c5c4N(c4ccc(-c6ccccc6)cc4B5c4c(C)cccc4C)c4cc5ccccc5c2c43)c(C)c1.Cc1cccc(C)c1B1c2cc3ccccc3cc2N2c3cc4ccccc4c4c3N(c3cc5ccccc5cc3B4c3c(C)cccc3C)c3cc4ccccc4c1c32.

What is the InChIKey of 13,34-bis(2,6-dimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5,7,9,11,14(44),15,17,19,21,24,26,28,30,32,35(43),36,38,40-icosaene;13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),11,14(44),15,17,19,21,24,26(31),32,35(43),36,38,40-hexadecaene;8,29-dicyclopentyl-13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),6,8,11,14(44),15,17,19,21,24,26(31),27,29,32,35(43),36,38,40-icosaene;9-(2,6-dimethylphenyl)-6-phenyl-26-(2,4,6-trimethylphenyl)-2,19-diaza-9,26-diboranonacyclo[17.15.1.12,10.03,8.011,16.020,25.027,35.028,33.018,36]hexatriaconta-1(34),3(8),4,6,10(36),11,13,15,17,20,22,24,27(35),28,30,32-hexadecaene?

The InChIKey is HQVWTPUOKSZCGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H60B2N2.C58H52B2N2.C56H40B2N2.C55H42B2N2/c1-39-27-41(3)63(42(4)28-39)69-57-33-53-31-47(45-15-7-8-16-45)23-25-49(53)35-59(57)71-62-38-52-20-12-14-22-56(52)66-68(62)72(61-37-51-19-11-13-21-55(51)65(69)67(61)71)60-36-50-26-24-48(46-17-9-10-18-46)32-54(50)34-58(60)70(66)64-43(5)29-40(2)30-44(64)6;1-33-23-35(3)53(36(4)24-33)59-47-27-39-15-7-9-17-41(39)29-49(47)61-52-32-44-20-12-14-22-46(44)56-58(52)62(51-31-43-19-11-13-21-45(43)55(59)57(51)61)50-30-42-18-10-8-16-40(42)28-48(50)60(56)54-37(5)25-34(2)26-38(54)6;1-33-15-13-16-34(2)51(33)57-45-27-37-19-5-7-21-39(37)29-47(45)59-50-32-42-24-10-12-26-44(42)54-56(50)60(49-31-41-23-9-11-25-43(41)53(57)55(49)59)48-30-40-22-8-6-20-38(40)28-46(48)58(54)52-35(3)17-14-18-36(52)4;1-33-28-36(4)51(37(5)29-33)56-44-24-13-14-25-46(44)58-48-31-41-21-10-12-23-43(41)53-55(48)59(49-32-40-20-9-11-22-42(40)52(56)54(49)58)47-27-26-39(38-18-7-6-8-19-38)30-45(47)57(53)50-34(2)16-15-17-35(50)3/h11-14,19-38,45-46H,7-10,15-18H2,1-6H3;11-14,19-32H,7-10,15-18H2,1-6H3;5-32H,1-4H3;6-32H,1-5H3.

What are the key properties of 13,34-bis(2,6-dimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5,7,9,11,14(44),15,17,19,21,24,26,28,30,32,35(43),36,38,40-icosaene;13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),11,14(44),15,17,19,21,24,26(31),32,35(43),36,38,40-hexadecaene;8,29-dicyclopentyl-13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),6,8,11,14(44),15,17,19,21,24,26(31),27,29,32,35(43),36,38,40-icosaene;9-(2,6-dimethylphenyl)-6-phenyl-26-(2,4,6-trimethylphenyl)-2,19-diaza-9,26-diboranonacyclo[17.15.1.12,10.03,8.011,16.020,25.027,35.028,33.018,36]hexatriaconta-1(34),3(8),4,6,10(36),11,13,15,17,20,22,24,27(35),28,30,32-hexadecaene?

13,34-bis(2,6-dimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5,7,9,11,14(44),15,17,19,21,24,26,28,30,32,35(43),36,38,40-icosaene;13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),11,14(44),15,17,19,21,24,26(31),32,35(43),36,38,40-hexadecaene;8,29-dicyclopentyl-13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),6,8,11,14(44),15,17,19,21,24,26(31),27,29,32,35(43),36,38,40-icosaene;9-(2,6-dimethylphenyl)-6-phenyl-26-(2,4,6-trimethylphenyl)-2,19-diaza-9,26-diboranonacyclo[17.15.1.12,10.03,8.011,16.020,25.027,35.028,33.018,36]hexatriaconta-1(34),3(8),4,6,10(36),11,13,15,17,20,22,24,27(35),28,30,32-hexadecaene has a molecular weight of 3240.71 g/mol, XLogP of 45.45, 11 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 13,34-bis(2,6-dimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5,7,9,11,14(44),15,17,19,21,24,26,28,30,32,35(43),36,38,40-icosaene;13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),11,14(44),15,17,19,21,24,26(31),32,35(43),36,38,40-hexadecaene;8,29-dicyclopentyl-13,34-bis(2,4,6-trimethylphenyl)-2,23-diaza-13,34-diboraundecacyclo[21.19.1.12,14.03,12.05,10.015,20.024,33.026,31.035,43.036,41.022,44]tetratetraconta-1(42),3,5(10),6,8,11,14(44),15,17,19,21,24,26(31),27,29,32,35(43),36,38,40-icosaene;9-(2,6-dimethylphenyl)-6-phenyl-26-(2,4,6-trimethylphenyl)-2,19-diaza-9,26-diboranonacyclo[17.15.1.12,10.03,8.011,16.020,25.027,35.028,33.018,36]hexatriaconta-1(34),3(8),4,6,10(36),11,13,15,17,20,22,24,27(35),28,30,32-hexadecaene is sourced from PubChem (CID 158560751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).