25-[2-(4-tert-butylphenyl)phenyl]-12,29,42-triphenyl-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2,4(26),6,8,10,13(50),14(22),15,17,19,23,27,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-(2-phenylphenyl)-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-[2-(3-phenylphenyl)phenyl]-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene

C226H144B6N12O6 — CID 165027070

About 25-[2-(4-tert-butylphenyl)phenyl]-12,29,42-triphenyl-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2,4(26),6,8,10,13(50),14(22),15,17,19,23,27,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-(2-phenylphenyl)-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-[2-(3-phenylphenyl)phenyl]-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene

25-[2-(4-tert-butylphenyl)phenyl]-12,29,42-triphenyl-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2,4(26),6,8,10,13(50),14(22),15,17,19,23,27,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-(2-phenylphenyl)-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-[2-(3-phenylphenyl)phenyl]-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene (PubChem CID 165027070) has the molecular formula C226H144B6N12O6 and a molecular weight of 3188.59 g/mol. Its IUPAC name is 25-[2-(4-tert-butylphenyl)phenyl]-12,29,42-triphenyl-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2,4(26),6,8,10,13(50),14(22),15,17,19,23,27,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-(2-phenylphenyl)-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-[2-(3-phenylphenyl)phenyl]-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene.

Molecular Properties

• Compound Name: 25-[2-(4-tert-butylphenyl)phenyl]-12,29,42-triphenyl-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2,4(26),6,8,10,13(50),14(22),15,17,19,23,27,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-(2-phenylphenyl)-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-[2-(3-phenylphenyl)phenyl]-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene
• PubChem CID: 165027070
• Molecular Formula: C226H144B6N12O6
• Molecular Weight: 3188.59 g/mol
• Exact Mass: 3187.19
• IUPAC Name: 25-[2-(4-tert-butylphenyl)phenyl]-12,29,42-triphenyl-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2,4(26),6,8,10,13(50),14(22),15,17,19,23,27,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-(2-phenylphenyl)-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-[2-(3-phenylphenyl)phenyl]-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene
• SMILES: CC(C)(C)c1ccc(-c2ccccc2N2c3cc4c(cc3B3c5ccccc5N(c5ccccc5)c5c3c2cc2oc3ccccc3c52)B2c3ccccc3N(c3ccccc3)c3c2c(cc2oc5ccccc5c32)N4c2ccccc2)cc1.c1ccc(-c2cccc(-c3ccccc3N3c4cc5c(cc4B4c6ccccc6N(c6ccccc6)c6c4c3cc3oc4ccccc4c63)B3c4ccccc4N(c4ccccc4)c4c3c(cc3oc6ccccc6c43)N5c3ccccc3)c2)cc1.c1ccc(-c2ccccc2N2c3cc4c(cc3B3c5ccccc5N(c5ccccc5)c5c3c2cc2oc3ccccc3c52)B2c3ccccc3N(c3ccccc3)c3c2c(cc2oc5ccccc5c32)N4c2ccccc2)cc1
• InChI: InChI=1S/C78H48B2N4O2.C76H52B2N4O2.C72H44B2N4O2/c1-5-24-49(25-6-1)50-26-23-27-51(44-50)55-34-13-18-39-62(55)84-66-46-65-60(45-61(66)80-59-38-17-20-41-64(59)83(54-32-11-4-12-33-54)78-74-57-36-15-22-43-70(57)86-72(74)48-68(84)76(78)80)79-58-37-16-19-40-63(58)82(53-30-9-3-10-31-53)77-73-56-35-14-21-42-69(56)85-71(73)47-67(75(77)79)81(65)52-28-7-2-8-29-52;1-76(2,3)48-41-39-47(40-42-48)52-29-13-18-34-59(52)82-63-44-62-57(43-58(63)78-56-33-17-20-36-61(56)81(51-27-11-6-12-28-51)75-71-54-31-15-22-38-67(54)84-69(71)46-65(82)73(75)78)77-55-32-16-19-35-60(55)80(50-25-9-5-10-26-50)74-70-53-30-14-21-37-66(53)83-68(70)45-64(72(74)77)79(62)49-23-7-4-8-24-49;1-5-23-45(24-6-1)49-31-13-18-36-56(49)78-60-42-59-54(41-55(60)74-53-35-17-20-38-58(53)77(48-29-11-4-12-30-48)72-68-51-33-15-22-40-64(51)80-66(68)44-62(78)70(72)74)73-52-34-16-19-37-57(52)76(47-27-9-3-10-28-47)71-67-50-32-14-21-39-63(50)79-65(67)43-61(69(71)73)75(59)46-25-7-2-8-26-46/h1-48H;4-46H,1-3H3;1-44H
• InChIKey: MBGPDBXIZWJJEU-UHFFFAOYSA-N
• XLogP: 48.92
• TPSA: 117.72 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 16
• Heavy Atoms: 250
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3188.59
LogP ≤ 5	48.92
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 25-[2-(4-tert-butylphenyl)phenyl]-12,29,42-triphenyl-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2,4(26),6,8,10,13(50),14(22),15,17,19,23,27,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-(2-phenylphenyl)-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-[2-(3-phenylphenyl)phenyl]-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene?

The IUPAC name of 25-[2-(4-tert-butylphenyl)phenyl]-12,29,42-triphenyl-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2,4(26),6,8,10,13(50),14(22),15,17,19,23,27,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-(2-phenylphenyl)-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-[2-(3-phenylphenyl)phenyl]-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene (CID 165027070) is 25-[2-(4-tert-butylphenyl)phenyl]-12,29,42-triphenyl-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2,4(26),6,8,10,13(50),14(22),15,17,19,23,27,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-(2-phenylphenyl)-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-[2-(3-phenylphenyl)phenyl]-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene.

What is the SMILES notation for 25-[2-(4-tert-butylphenyl)phenyl]-12,29,42-triphenyl-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2,4(26),6,8,10,13(50),14(22),15,17,19,23,27,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-(2-phenylphenyl)-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-[2-(3-phenylphenyl)phenyl]-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene?

The canonical SMILES for 25-[2-(4-tert-butylphenyl)phenyl]-12,29,42-triphenyl-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2,4(26),6,8,10,13(50),14(22),15,17,19,23,27,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-(2-phenylphenyl)-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-[2-(3-phenylphenyl)phenyl]-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene is CC(C)(C)c1ccc(-c2ccccc2N2c3cc4c(cc3B3c5ccccc5N(c5ccccc5)c5c3c2cc2oc3ccccc3c52)B2c3ccccc3N(c3ccccc3)c3c2c(cc2oc5ccccc5c32)N4c2ccccc2)cc1.c1ccc(-c2cccc(-c3ccccc3N3c4cc5c(cc4B4c6ccccc6N(c6ccccc6)c6c4c3cc3oc4ccccc4c63)B3c4ccccc4N(c4ccccc4)c4c3c(cc3oc6ccccc6c43)N5c3ccccc3)c2)cc1.c1ccc(-c2ccccc2N2c3cc4c(cc3B3c5ccccc5N(c5ccccc5)c5c3c2cc2oc3ccccc3c52)B2c3ccccc3N(c3ccccc3)c3c2c(cc2oc5ccccc5c32)N4c2ccccc2)cc1.

What is the InChIKey of 25-[2-(4-tert-butylphenyl)phenyl]-12,29,42-triphenyl-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2,4(26),6,8,10,13(50),14(22),15,17,19,23,27,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-(2-phenylphenyl)-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-[2-(3-phenylphenyl)phenyl]-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene?

The InChIKey is MBGPDBXIZWJJEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C78H48B2N4O2.C76H52B2N4O2.C72H44B2N4O2/c1-5-24-49(25-6-1)50-26-23-27-51(44-50)55-34-13-18-39-62(55)84-66-46-65-60(45-61(66)80-59-38-17-20-41-64(59)83(54-32-11-4-12-33-54)78-74-57-36-15-22-43-70(57)86-72(74)48-68(84)76(78)80)79-58-37-16-19-40-63(58)82(53-30-9-3-10-31-53)77-73-56-35-14-21-42-69(56)85-71(73)47-67(75(77)79)81(65)52-28-7-2-8-29-52;1-76(2,3)48-41-39-47(40-42-48)52-29-13-18-34-59(52)82-63-44-62-57(43-58(63)78-56-33-17-20-36-61(56)81(51-27-11-6-12-28-51)75-71-54-31-15-22-38-67(54)84-69(71)46-65(82)73(75)78)77-55-32-16-19-35-60(55)80(50-25-9-5-10-26-50)74-70-53-30-14-21-37-66(53)83-68(70)45-64(72(74)77)79(62)49-23-7-4-8-24-49;1-5-23-45(24-6-1)49-31-13-18-36-56(49)78-60-42-59-54(41-55(60)74-53-35-17-20-38-58(53)77(48-29-11-4-12-30-48)72-68-51-33-15-22-40-64(51)80-66(68)44-62(78)70(72)74)73-52-34-16-19-37-57(52)76(47-27-9-3-10-28-47)71-67-50-32-14-21-39-63(50)79-65(67)43-61(69(71)73)75(59)46-25-7-2-8-26-46/h1-48H;4-46H,1-3H3;1-44H.

What are the key properties of 25-[2-(4-tert-butylphenyl)phenyl]-12,29,42-triphenyl-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2,4(26),6,8,10,13(50),14(22),15,17,19,23,27,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-(2-phenylphenyl)-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-[2-(3-phenylphenyl)phenyl]-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene?

25-[2-(4-tert-butylphenyl)phenyl]-12,29,42-triphenyl-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2,4(26),6,8,10,13(50),14(22),15,17,19,23,27,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-(2-phenylphenyl)-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-[2-(3-phenylphenyl)phenyl]-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene has a molecular weight of 3188.59 g/mol, XLogP of 48.92, 16 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 25-[2-(4-tert-butylphenyl)phenyl]-12,29,42-triphenyl-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2,4(26),6,8,10,13(50),14(22),15,17,19,23,27,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-(2-phenylphenyl)-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene;12,25,42-triphenyl-29-[2-(3-phenylphenyl)phenyl]-21,33-dioxa-12,25,29,42-tetraza-1,5-diboratridecacyclo[28.18.1.15,13.02,28.04,26.06,11.014,22.015,20.032,40.034,39.041,49.043,48.024,50]pentaconta-2(28),3,6,8,10,13(50),14(22),15,17,19,23,26,30,32(40),34,36,38,41(49),43,45,47-henicosaene is sourced from PubChem (CID 165027070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).