25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene

C222H192B4N8Si4 — CID 163474614

IUPAC25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene
SMILESCC(C)(C)c1ccc2c(c1)B1c3cc4c(cc3N(c3ccccc3)c3cccc(c31)N2c1ccccc1)-c1ccccc1[Si]4(c1ccccc1)c1ccccc1.Cc1cc2c3c(c1)N(c1c(C)cccc1C)c1cc4c(cc1B3c1cc(C(C)(C)C)ccc1N2c1ccc(C(C)(C)C)cc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1-4.Cc1cc2c3c(c1)N(c1ccccc1)c1cc4c(cc1B3c1cc(C(C)(C)C)ccc1N2c1ccccc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1-4.Cc1cc2c3c(c1)N(c1ccccc1C)c1cc4c(cc1B3c1cc(C(C)(C)C)ccc1N2c1ccc(C(C)(C)C)cc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1-4
InChIInChI=1S/C59H55BN2Si.C58H53BN2Si.C53H43BN2Si.C52H41BN2Si/c1-38-33-52-56-53(34-38)62(57-39(2)19-18-20-40(57)3)51-36-47-46-25-16-17-26-54(46)63(44-21-12-10-13-22-44,45-23-14-11-15-24-45)55(47)37-49(51)60(56)48-35-42(59(7,8)9)29-32-50(48)61(52)43-30-27-41(28-31-43)58(4,5)6;1-38-33-52-56-53(34-38)61(49-25-17-15-19-39(49)2)51-36-46-45-24-16-18-26-54(45)62(43-20-11-9-12-21-43,44-22-13-10-14-23-44)55(46)37-48(51)59(56)47-35-41(58(6,7)8)29-32-50(47)60(52)42-30-27-40(28-31-42)57(3,4)5;1-36-31-48-52-49(32-36)56(39-21-11-6-12-22-39)47-34-43-42-27-17-18-28-50(42)57(40-23-13-7-14-24-40,41-25-15-8-16-26-41)51(43)35-45(47)54(52)44-33-37(53(2,3)4)29-30-46(44)55(48)38-19-9-5-10-20-38;1-52(2,3)36-31-32-45-43(33-36)53-44-35-50-42(41-27-16-17-30-49(41)56(50,39-23-12-6-13-24-39)40-25-14-7-15-26-40)34-48(44)55(38-21-10-5-11-22-38)47-29-18-28-46(51(47)53)54(45)37-19-8-4-9-20-37/h10-37H,1-9H3;9-37H,1-8H3;5-35H,1-4H3;4-35H,1-3H3
InChIKeyBZKNPHFUSVCRKZ-UHFFFAOYSA-N
MW3127.63 g/mol
LogP38.14
Rot. Bonds16

About 25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene

25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene (PubChem CID 163474614) has the molecular formula C222H192B4N8Si4 and a molecular weight of 3127.63 g/mol. Its IUPAC name is 25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene.

Molecular Properties

Compound Name25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene
PubChem CID163474614
Molecular FormulaC222H192B4N8Si4
Molecular Weight3127.63 g/mol
Exact Mass3125.47
IUPAC Name25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene
SMILESCC(C)(C)c1ccc2c(c1)B1c3cc4c(cc3N(c3ccccc3)c3cccc(c31)N2c1ccccc1)-c1ccccc1[Si]4(c1ccccc1)c1ccccc1.Cc1cc2c3c(c1)N(c1c(C)cccc1C)c1cc4c(cc1B3c1cc(C(C)(C)C)ccc1N2c1ccc(C(C)(C)C)cc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1-4.Cc1cc2c3c(c1)N(c1ccccc1)c1cc4c(cc1B3c1cc(C(C)(C)C)ccc1N2c1ccccc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1-4.Cc1cc2c3c(c1)N(c1ccccc1C)c1cc4c(cc1B3c1cc(C(C)(C)C)ccc1N2c1ccc(C(C)(C)C)cc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1-4
InChIInChI=1S/C59H55BN2Si.C58H53BN2Si.C53H43BN2Si.C52H41BN2Si/c1-38-33-52-56-53(34-38)62(57-39(2)19-18-20-40(57)3)51-36-47-46-25-16-17-26-54(46)63(44-21-12-10-13-22-44,45-23-14-11-15-24-45)55(47)37-49(51)60(56)48-35-42(59(7,8)9)29-32-50(48)61(52)43-30-27-41(28-31-43)58(4,5)6;1-38-33-52-56-53(34-38)61(49-25-17-15-19-39(49)2)51-36-46-45-24-16-18-26-54(45)62(43-20-11-9-12-21-43,44-22-13-10-14-23-44)55(46)37-48(51)59(56)47-35-41(58(6,7)8)29-32-50(47)60(52)42-30-27-40(28-31-42)57(3,4)5;1-36-31-48-52-49(32-36)56(39-21-11-6-12-22-39)47-34-43-42-27-17-18-28-50(42)57(40-23-13-7-14-24-40,41-25-15-8-16-26-41)51(43)35-45(47)54(52)44-33-37(53(2,3)4)29-30-46(44)55(48)38-19-9-5-10-20-38;1-52(2,3)36-31-32-45-43(33-36)53-44-35-50-42(41-27-16-17-30-49(41)56(50,39-23-12-6-13-24-39)40-25-14-7-15-26-40)34-48(44)55(38-21-10-5-11-22-38)47-29-18-28-46(51(47)53)54(45)37-19-8-4-9-20-37/h10-37H,1-9H3;9-37H,1-8H3;5-35H,1-4H3;4-35H,1-3H3
InChIKeyBZKNPHFUSVCRKZ-UHFFFAOYSA-N
XLogP38.14
TPSA25.92 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds16
Heavy Atoms238
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003127.63
LogP ≤ 538.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze 25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene?
The IUPAC name of 25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene (CID 163474614) is 25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene.
What is the SMILES notation for 25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene?
The canonical SMILES for 25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene is CC(C)(C)c1ccc2c(c1)B1c3cc4c(cc3N(c3ccccc3)c3cccc(c31)N2c1ccccc1)-c1ccccc1[Si]4(c1ccccc1)c1ccccc1.Cc1cc2c3c(c1)N(c1c(C)cccc1C)c1cc4c(cc1B3c1cc(C(C)(C)C)ccc1N2c1ccc(C(C)(C)C)cc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1-4.Cc1cc2c3c(c1)N(c1ccccc1)c1cc4c(cc1B3c1cc(C(C)(C)C)ccc1N2c1ccccc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1-4.Cc1cc2c3c(c1)N(c1ccccc1C)c1cc4c(cc1B3c1cc(C(C)(C)C)ccc1N2c1ccc(C(C)(C)C)cc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1-4.
What is the InChIKey of 25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene?
The InChIKey is BZKNPHFUSVCRKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H55BN2Si.C58H53BN2Si.C53H43BN2Si.C52H41BN2Si/c1-38-33-52-56-53(34-38)62(57-39(2)19-18-20-40(57)3)51-36-47-46-25-16-17-26-54(46)63(44-21-12-10-13-22-44,45-23-14-11-15-24-45)55(47)37-49(51)60(56)48-35-42(59(7,8)9)29-32-50(48)61(52)43-30-27-41(28-31-43)58(4,5)6;1-38-33-52-56-53(34-38)61(49-25-17-15-19-39(49)2)51-36-46-45-24-16-18-26-54(45)62(43-20-11-9-12-21-43,44-22-13-10-14-23-44)55(46)37-48(51)59(56)47-35-41(58(6,7)8)29-32-50(47)60(52)42-30-27-40(28-31-42)57(3,4)5;1-36-31-48-52-49(32-36)56(39-21-11-6-12-22-39)47-34-43-42-27-17-18-28-50(42)57(40-23-13-7-14-24-40,41-25-15-8-16-26-41)51(43)35-45(47)54(52)44-33-37(53(2,3)4)29-30-46(44)55(48)38-19-9-5-10-20-38;1-52(2,3)36-31-32-45-43(33-36)53-44-35-50-42(41-27-16-17-30-49(41)56(50,39-23-12-6-13-24-39)40-25-14-7-15-26-40)34-48(44)55(38-21-10-5-11-22-38)47-29-18-28-46(51(47)53)54(45)37-19-8-4-9-20-37/h10-37H,1-9H3;9-37H,1-8H3;5-35H,1-4H3;4-35H,1-3H3.
What are the key properties of 25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene?
25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene has a molecular weight of 3127.63 g/mol, XLogP of 38.14, 16 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 25-tert-butyl-21-(4-tert-butylphenyl)-15-(2,6-dimethylphenyl)-18-methyl-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-21-(4-tert-butylphenyl)-18-methyl-15-(2-methylphenyl)-5,5-diphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-18-methyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene;25-tert-butyl-5,5,15,21-tetraphenyl-15,21-diaza-5-sila-1-boraheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene is sourced from PubChem (CID 163474614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).