5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;14-(4-tert-butylphenyl)-11-methyl-8-phenyl-16-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,22]tetracosa-2,4,6,9(24),10,12,15(23),17,19,21-decaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;11-methyl-8,14-diphenyl-22-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.016,21]tetracosa-2,4,6,9(24),10,12,15(23),16,18,20-decaene

C210H186B6N12O2S4 — CID 165074208

About 5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;14-(4-tert-butylphenyl)-11-methyl-8-phenyl-16-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,22]tetracosa-2,4,6,9(24),10,12,15(23),17,19,21-decaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;11-methyl-8,14-diphenyl-22-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.016,21]tetracosa-2,4,6,9(24),10,12,15(23),16,18,20-decaene

5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;14-(4-tert-butylphenyl)-11-methyl-8-phenyl-16-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,22]tetracosa-2,4,6,9(24),10,12,15(23),17,19,21-decaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;11-methyl-8,14-diphenyl-22-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.016,21]tetracosa-2,4,6,9(24),10,12,15(23),16,18,20-decaene (PubChem CID 165074208) has the molecular formula C210H186B6N12O2S4 and a molecular weight of 3103.02 g/mol. Its IUPAC name is 5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;14-(4-tert-butylphenyl)-11-methyl-8-phenyl-16-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,22]tetracosa-2,4,6,9(24),10,12,15(23),17,19,21-decaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;11-methyl-8,14-diphenyl-22-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.016,21]tetracosa-2,4,6,9(24),10,12,15(23),16,18,20-decaene.

Molecular Properties

• Compound Name: 5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;14-(4-tert-butylphenyl)-11-methyl-8-phenyl-16-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,22]tetracosa-2,4,6,9(24),10,12,15(23),17,19,21-decaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;11-methyl-8,14-diphenyl-22-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.016,21]tetracosa-2,4,6,9(24),10,12,15(23),16,18,20-decaene
• PubChem CID: 165074208
• Molecular Formula: C210H186B6N12O2S4
• Molecular Weight: 3103.02 g/mol
• Exact Mass: 3101.43
• IUPAC Name: 5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;14-(4-tert-butylphenyl)-11-methyl-8-phenyl-16-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,22]tetracosa-2,4,6,9(24),10,12,15(23),17,19,21-decaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;11-methyl-8,14-diphenyl-22-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.016,21]tetracosa-2,4,6,9(24),10,12,15(23),16,18,20-decaene
• SMILES: Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1c(C(C)(C)C)coc1B3c1ccccc1N2c1ccccc1.Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1c(C(C)(C)C)csc1B3c1ccccc1N2c1ccccc1.Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1occc1B3c1ccccc1N2c1ccccc1.Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1sc4ccccc4c1B3c1ccccc1N2c1ccccc1.Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1sccc1B3c1ccccc1N2c1ccccc1.Cc1cc2c3c(c1)N(c1ccccc1)c1c(sc4ccccc14)B3c1ccccc1N2c1ccccc1
• InChI: InChI=1S/C37H37BN2O.C37H31BN2S.C37H37BN2S.C33H29BN2O.C33H23BN2S.C33H29BN2S/c1-24-21-31-33-32(22-24)40(27-19-17-25(18-20-27)36(2,3)4)34-28(37(5,6)7)23-41-35(34)38(33)29-15-11-12-16-30(29)39(31)26-13-9-8-10-14-26;1-24-22-31-35-32(23-24)40(27-20-18-25(19-21-27)37(2,3)4)36-34(28-14-8-11-17-33(28)41-36)38(35)29-15-9-10-16-30(29)39(31)26-12-6-5-7-13-26;1-24-21-31-33-32(22-24)40(27-19-17-25(18-20-27)36(2,3)4)34-28(37(5,6)7)23-41-35(34)38(33)29-15-11-12-16-30(29)39(31)26-13-9-8-10-14-26;1-22-20-29-31-30(21-22)36(25-16-14-23(15-17-25)33(2,3)4)32-27(18-19-37-32)34(31)26-12-8-9-13-28(26)35(29)24-10-6-5-7-11-24;1-22-20-28-31-29(21-22)36(24-14-6-3-7-15-24)32-25-16-8-11-19-30(25)37-33(32)34(31)26-17-9-10-18-27(26)35(28)23-12-4-2-5-13-23;1-22-20-29-31-30(21-22)36(25-16-14-23(15-17-25)33(2,3)4)32-27(18-19-37-32)34(31)26-12-8-9-13-28(26)35(29)24-10-6-5-7-11-24/h8-23H,1-7H3;5-23H,1-4H3;8-23H,1-7H3;5-21H,1-4H3;2-21H,1H3;5-21H,1-4H3
• InChIKey: UANGANXMUBIEBP-UHFFFAOYSA-N
• XLogP: 47.29
• TPSA: 65.16 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 12
• Heavy Atoms: 234
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3103.02
LogP ≤ 5	47.29
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 5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;14-(4-tert-butylphenyl)-11-methyl-8-phenyl-16-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,22]tetracosa-2,4,6,9(24),10,12,15(23),17,19,21-decaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;11-methyl-8,14-diphenyl-22-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.016,21]tetracosa-2,4,6,9(24),10,12,15(23),16,18,20-decaene?

The IUPAC name of 5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;14-(4-tert-butylphenyl)-11-methyl-8-phenyl-16-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,22]tetracosa-2,4,6,9(24),10,12,15(23),17,19,21-decaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;11-methyl-8,14-diphenyl-22-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.016,21]tetracosa-2,4,6,9(24),10,12,15(23),16,18,20-decaene (CID 165074208) is 5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;14-(4-tert-butylphenyl)-11-methyl-8-phenyl-16-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,22]tetracosa-2,4,6,9(24),10,12,15(23),17,19,21-decaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;11-methyl-8,14-diphenyl-22-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.016,21]tetracosa-2,4,6,9(24),10,12,15(23),16,18,20-decaene.

What is the SMILES notation for 5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;14-(4-tert-butylphenyl)-11-methyl-8-phenyl-16-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,22]tetracosa-2,4,6,9(24),10,12,15(23),17,19,21-decaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;11-methyl-8,14-diphenyl-22-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.016,21]tetracosa-2,4,6,9(24),10,12,15(23),16,18,20-decaene?

The canonical SMILES for 5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;14-(4-tert-butylphenyl)-11-methyl-8-phenyl-16-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,22]tetracosa-2,4,6,9(24),10,12,15(23),17,19,21-decaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;11-methyl-8,14-diphenyl-22-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.016,21]tetracosa-2,4,6,9(24),10,12,15(23),16,18,20-decaene is Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1c(C(C)(C)C)coc1B3c1ccccc1N2c1ccccc1.Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1c(C(C)(C)C)csc1B3c1ccccc1N2c1ccccc1.Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1occc1B3c1ccccc1N2c1ccccc1.Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1sc4ccccc4c1B3c1ccccc1N2c1ccccc1.Cc1cc2c3c(c1)N(c1ccc(C(C)(C)C)cc1)c1sccc1B3c1ccccc1N2c1ccccc1.Cc1cc2c3c(c1)N(c1ccccc1)c1c(sc4ccccc14)B3c1ccccc1N2c1ccccc1.

What is the InChIKey of 5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;14-(4-tert-butylphenyl)-11-methyl-8-phenyl-16-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,22]tetracosa-2,4,6,9(24),10,12,15(23),17,19,21-decaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;11-methyl-8,14-diphenyl-22-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.016,21]tetracosa-2,4,6,9(24),10,12,15(23),16,18,20-decaene?

The InChIKey is UANGANXMUBIEBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H37BN2O.C37H31BN2S.C37H37BN2S.C33H29BN2O.C33H23BN2S.C33H29BN2S/c1-24-21-31-33-32(22-24)40(27-19-17-25(18-20-27)36(2,3)4)34-28(37(5,6)7)23-41-35(34)38(33)29-15-11-12-16-30(29)39(31)26-13-9-8-10-14-26;1-24-22-31-35-32(23-24)40(27-20-18-25(19-21-27)37(2,3)4)36-34(28-14-8-11-17-33(28)41-36)38(35)29-15-9-10-16-30(29)39(31)26-12-6-5-7-13-26;1-24-21-31-33-32(22-24)40(27-19-17-25(18-20-27)36(2,3)4)34-28(37(5,6)7)23-41-35(34)38(33)29-15-11-12-16-30(29)39(31)26-13-9-8-10-14-26;1-22-20-29-31-30(21-22)36(25-16-14-23(15-17-25)33(2,3)4)32-27(18-19-37-32)34(31)26-12-8-9-13-28(26)35(29)24-10-6-5-7-11-24;1-22-20-28-31-29(21-22)36(24-14-6-3-7-15-24)32-25-16-8-11-19-30(25)37-33(32)34(31)26-17-9-10-18-27(26)35(28)23-12-4-2-5-13-23;1-22-20-29-31-30(21-22)36(25-16-14-23(15-17-25)33(2,3)4)32-27(18-19-37-32)34(31)26-12-8-9-13-28(26)35(29)24-10-6-5-7-11-24/h8-23H,1-7H3;5-23H,1-4H3;8-23H,1-7H3;5-21H,1-4H3;2-21H,1H3;5-21H,1-4H3.

What are the key properties of 5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;14-(4-tert-butylphenyl)-11-methyl-8-phenyl-16-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,22]tetracosa-2,4,6,9(24),10,12,15(23),17,19,21-decaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;11-methyl-8,14-diphenyl-22-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.016,21]tetracosa-2,4,6,9(24),10,12,15(23),16,18,20-decaene?

5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;14-(4-tert-butylphenyl)-11-methyl-8-phenyl-16-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,22]tetracosa-2,4,6,9(24),10,12,15(23),17,19,21-decaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;11-methyl-8,14-diphenyl-22-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.016,21]tetracosa-2,4,6,9(24),10,12,15(23),16,18,20-decaene has a molecular weight of 3103.02 g/mol, XLogP of 47.29, 12 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;5-tert-butyl-7-(4-tert-butylphenyl)-10-methyl-13-phenyl-3-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),4,8,10,12(20),14,16,18-octaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-oxa-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;14-(4-tert-butylphenyl)-11-methyl-8-phenyl-16-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,22]tetracosa-2,4,6,9(24),10,12,15(23),17,19,21-decaene;7-(4-tert-butylphenyl)-10-methyl-13-phenyl-5-thia-7,13-diaza-1-borapentacyclo[10.7.1.02,6.08,20.014,19]icosa-2(6),3,8,10,12(20),14,16,18-octaene;11-methyl-8,14-diphenyl-22-thia-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.016,21]tetracosa-2,4,6,9(24),10,12,15(23),16,18,20-decaene is sourced from PubChem (CID 165074208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).