N,N-bis(4-tert-butylphenyl)-23-(4-tert-butyl-2-phenylphenyl)-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-23-dibenzofuran-1-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-26-methyl-23-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;20-tert-butyl-23-dibenzofuran-4-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaene

C227H199B4N11O2S4 — CID 164957760

About N,N-bis(4-tert-butylphenyl)-23-(4-tert-butyl-2-phenylphenyl)-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-23-dibenzofuran-1-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-26-methyl-23-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;20-tert-butyl-23-dibenzofuran-4-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaene

N,N-bis(4-tert-butylphenyl)-23-(4-tert-butyl-2-phenylphenyl)-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-23-dibenzofuran-1-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-26-methyl-23-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;20-tert-butyl-23-dibenzofuran-4-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaene (PubChem CID 164957760) has the molecular formula C227H199B4N11O2S4 and a molecular weight of 3284.68 g/mol. Its IUPAC name is N,N-bis(4-tert-butylphenyl)-23-(4-tert-butyl-2-phenylphenyl)-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-23-dibenzofuran-1-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-26-methyl-23-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;20-tert-butyl-23-dibenzofuran-4-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaene.

Molecular Properties

• Compound Name: N,N-bis(4-tert-butylphenyl)-23-(4-tert-butyl-2-phenylphenyl)-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-23-dibenzofuran-1-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-26-methyl-23-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;20-tert-butyl-23-dibenzofuran-4-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaene
• PubChem CID: 164957760
• Molecular Formula: C227H199B4N11O2S4
• Molecular Weight: 3284.68 g/mol
• Exact Mass: 3282.51
• IUPAC Name: N,N-bis(4-tert-butylphenyl)-23-(4-tert-butyl-2-phenylphenyl)-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-23-dibenzofuran-1-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-26-methyl-23-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;20-tert-butyl-23-dibenzofuran-4-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaene
• SMILES: Cc1cc2c3c(c1)-n1c4c(cccc4c4sc5ccccc5c41)B3c1ccc(C(C)(C)C)cc1N2c1cccc2c1oc1ccccc12.Cc1cc2c3c(c1)-n1c4c(cccc4c4sc5ccccc5c41)B3c1ccc(N(c3ccc(C(C)(C)C)cc3)c3ccc(C(C)(C)C)cc3)cc1N2c1cc2c(cc1C)C(C)(C)CCC2(C)C.Cc1cc2c3c(c1)-n1c4c(cccc4c4sc5ccccc5c41)B3c1ccc(N(c3ccc(C(C)(C)C)cc3)c3ccc(C(C)(C)C)cc3)cc1N2c1ccc(C(C)(C)C)cc1-c1ccccc1.Cc1cc2c3c(c1)-n1c4c(cccc4c4sc5ccccc5c41)B3c1ccc(N(c3ccc(C(C)(C)C)cc3)c3ccc(C(C)(C)C)cc3)cc1N2c1cccc2oc3ccccc3c12
• InChI: InChI=1S/C63H58BN3S.C62H62BN3S.C59H48BN3OS.C43H31BN2OS/c1-39-35-54-57-55(36-39)67-58-48(60-59(67)47-19-14-15-22-56(47)68-60)20-16-21-51(58)64(57)50-33-32-46(38-53(50)66(54)52-34-27-43(63(8,9)10)37-49(52)40-17-12-11-13-18-40)65(44-28-23-41(24-29-44)61(2,3)4)45-30-25-42(26-31-45)62(5,6)7;1-37-32-52-55-53(33-37)66-56-45(58-57(66)44-16-13-14-19-54(44)67-58)17-15-18-49(56)63(55)48-29-28-43(35-51(48)65(52)50-36-47-46(34-38(50)2)61(9,10)30-31-62(47,11)12)64(41-24-20-39(21-25-41)59(3,4)5)42-26-22-40(23-27-42)60(6,7)8;1-35-32-48-54-49(33-35)63-55-43(57-56(63)42-15-9-11-21-52(42)65-57)16-12-17-45(55)60(54)44-31-30-40(34-47(44)62(48)46-18-13-20-51-53(46)41-14-8-10-19-50(41)64-51)61(38-26-22-36(23-27-38)58(2,3)4)39-28-24-37(25-29-39)59(5,6)7;1-24-21-34-38-35(22-24)46-39-29(42-40(46)28-12-6-8-18-37(28)48-42)14-9-15-31(39)44(38)30-20-19-25(43(2,3)4)23-33(30)45(34)32-16-10-13-27-26-11-5-7-17-36(26)47-41(27)32/h11-38H,1-10H3;13-29,32-36H,30-31H2,1-12H3;8-34H,1-7H3;5-23H,1-4H3
• InChIKey: BKFJCELNHLKPMK-UHFFFAOYSA-N
• XLogP: 56.59
• TPSA: 68.68 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 14
• Heavy Atoms: 248
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3284.68
LogP ≤ 5	56.59
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-tert-butylphenyl)-23-(4-tert-butyl-2-phenylphenyl)-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-23-dibenzofuran-1-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-26-methyl-23-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;20-tert-butyl-23-dibenzofuran-4-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaene?

The IUPAC name of N,N-bis(4-tert-butylphenyl)-23-(4-tert-butyl-2-phenylphenyl)-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-23-dibenzofuran-1-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-26-methyl-23-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;20-tert-butyl-23-dibenzofuran-4-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaene (CID 164957760) is N,N-bis(4-tert-butylphenyl)-23-(4-tert-butyl-2-phenylphenyl)-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-23-dibenzofuran-1-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-26-methyl-23-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;20-tert-butyl-23-dibenzofuran-4-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaene.

What is the SMILES notation for N,N-bis(4-tert-butylphenyl)-23-(4-tert-butyl-2-phenylphenyl)-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-23-dibenzofuran-1-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-26-methyl-23-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;20-tert-butyl-23-dibenzofuran-4-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaene?

The canonical SMILES for N,N-bis(4-tert-butylphenyl)-23-(4-tert-butyl-2-phenylphenyl)-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-23-dibenzofuran-1-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-26-methyl-23-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;20-tert-butyl-23-dibenzofuran-4-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaene is Cc1cc2c3c(c1)-n1c4c(cccc4c4sc5ccccc5c41)B3c1ccc(C(C)(C)C)cc1N2c1cccc2c1oc1ccccc12.Cc1cc2c3c(c1)-n1c4c(cccc4c4sc5ccccc5c41)B3c1ccc(N(c3ccc(C(C)(C)C)cc3)c3ccc(C(C)(C)C)cc3)cc1N2c1cc2c(cc1C)C(C)(C)CCC2(C)C.Cc1cc2c3c(c1)-n1c4c(cccc4c4sc5ccccc5c41)B3c1ccc(N(c3ccc(C(C)(C)C)cc3)c3ccc(C(C)(C)C)cc3)cc1N2c1ccc(C(C)(C)C)cc1-c1ccccc1.Cc1cc2c3c(c1)-n1c4c(cccc4c4sc5ccccc5c41)B3c1ccc(N(c3ccc(C(C)(C)C)cc3)c3ccc(C(C)(C)C)cc3)cc1N2c1cccc2oc3ccccc3c12.

What is the InChIKey of N,N-bis(4-tert-butylphenyl)-23-(4-tert-butyl-2-phenylphenyl)-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-23-dibenzofuran-1-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-26-methyl-23-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;20-tert-butyl-23-dibenzofuran-4-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaene?

The InChIKey is BKFJCELNHLKPMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H58BN3S.C62H62BN3S.C59H48BN3OS.C43H31BN2OS/c1-39-35-54-57-55(36-39)67-58-48(60-59(67)47-19-14-15-22-56(47)68-60)20-16-21-51(58)64(57)50-33-32-46(38-53(50)66(54)52-34-27-43(63(8,9)10)37-49(52)40-17-12-11-13-18-40)65(44-28-23-41(24-29-44)61(2,3)4)45-30-25-42(26-31-45)62(5,6)7;1-37-32-52-55-53(33-37)66-56-45(58-57(66)44-16-13-14-19-54(44)67-58)17-15-18-49(56)63(55)48-29-28-43(35-51(48)65(52)50-36-47-46(34-38(50)2)61(9,10)30-31-62(47,11)12)64(41-24-20-39(21-25-41)59(3,4)5)42-26-22-40(23-27-42)60(6,7)8;1-35-32-48-54-49(33-35)63-55-43(57-56(63)42-15-9-11-21-52(42)65-57)16-12-17-45(55)60(54)44-31-30-40(34-47(44)62(48)46-18-13-20-51-53(46)41-14-8-10-19-50(41)64-51)61(38-26-22-36(23-27-38)58(2,3)4)39-28-24-37(25-29-39)59(5,6)7;1-24-21-34-38-35(22-24)46-39-29(42-40(46)28-12-6-8-18-37(28)48-42)14-9-15-31(39)44(38)30-20-19-25(43(2,3)4)23-33(30)45(34)32-16-10-13-27-26-11-5-7-17-36(26)47-41(27)32/h11-38H,1-10H3;13-29,32-36H,30-31H2,1-12H3;8-34H,1-7H3;5-23H,1-4H3.

What are the key properties of N,N-bis(4-tert-butylphenyl)-23-(4-tert-butyl-2-phenylphenyl)-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-23-dibenzofuran-1-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-26-methyl-23-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;20-tert-butyl-23-dibenzofuran-4-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaene?

N,N-bis(4-tert-butylphenyl)-23-(4-tert-butyl-2-phenylphenyl)-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-23-dibenzofuran-1-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-26-methyl-23-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;20-tert-butyl-23-dibenzofuran-4-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaene has a molecular weight of 3284.68 g/mol, XLogP of 56.59, 14 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-bis(4-tert-butylphenyl)-23-(4-tert-butyl-2-phenylphenyl)-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-23-dibenzofuran-1-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;N,N-bis(4-tert-butylphenyl)-26-methyl-23-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaen-20-amine;20-tert-butyl-23-dibenzofuran-4-yl-26-methyl-9-thia-1,23-diaza-16-boraoctacyclo[13.13.1.116,24.02,10.03,8.011,29.017,22.028,30]triaconta-2(10),3,5,7,11,13,15(29),17(22),18,20,24,26,28(30)-tridecaene is sourced from PubChem (CID 164957760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).