14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene

C201H227B3N10OS — CID 163935763

IUPAC14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene
SMILESCC(C)(C)c1ccc(-c2ccc(-c3nc4cc5c(cc4n3-c3ccccc3)B3c4ccc(C(C)(C)C)c6c4N(c4cc(C(C)(C)C)cc(c43)N5c3ccc4c(c3)C(C)(C)CCC4(C)C)C3(C)CCCCC63C)cc2)cc1.CC(C)(C)c1ccc(-c2ccc(-c3nc4cc5c(cc4o3)B3c4ccc(C(C)(C)C)c6c4N(c4cc(C(C)(C)C)cc(c43)N5c3ccc4c(c3)C(C)(C)CCC4(C)C)C3(C)CCCCC63C)cc2)cc1.CC(C)(C)c1ccc(-c2ccc(-c3nc4cc5c(cc4s3)B3c4ccc(C(C)(C)C)c6c4N(c4cc(C(C)(C)C)cc(c43)N5c3ccc4c(c3)C(C)(C)CCC4(C)C)C3(C)CCCCC63C)cc2)cc1
InChIInChI=1S/C71H79BN4.C65H74BN3O.C65H74BN3S/c1-65(2,3)47-29-27-45(28-30-47)44-23-25-46(26-24-44)64-73-56-43-57-55(42-58(56)75(64)49-21-17-16-18-22-49)72-54-34-33-52(67(7,8)9)61-63(54)76(71(15)36-20-19-35-70(61,71)14)60-40-48(66(4,5)6)39-59(62(60)72)74(57)50-31-32-51-53(41-50)69(12,13)38-37-68(51,10)11;2*1-59(2,3)42-24-22-40(23-25-42)39-18-20-41(21-19-39)58-67-50-38-51-49(37-54(50)70-58)66-48-29-28-46(61(7,8)9)55-57(48)69(65(15)31-17-16-30-64(55,65)14)53-35-43(60(4,5)6)34-52(56(53)66)68(51)44-26-27-45-47(36-44)63(12,13)33-32-62(45,10)11/h16-18,21-34,39-43H,19-20,35-38H2,1-15H3;2*18-29,34-38H,16-17,30-33H2,1-15H3
InChIKeyRMRDIMYLXWPEIX-UHFFFAOYSA-N
MW2863.60 g/mol
LogP48.94
Rot. Bonds10

About 14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene

14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene (PubChem CID 163935763) has the molecular formula C201H227B3N10OS and a molecular weight of 2863.60 g/mol. Its IUPAC name is 14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene.

Molecular Properties

Compound Name14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene
PubChem CID163935763
Molecular FormulaC201H227B3N10OS
Molecular Weight2863.60 g/mol
Exact Mass2861.80
IUPAC Name14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene
SMILESCC(C)(C)c1ccc(-c2ccc(-c3nc4cc5c(cc4n3-c3ccccc3)B3c4ccc(C(C)(C)C)c6c4N(c4cc(C(C)(C)C)cc(c43)N5c3ccc4c(c3)C(C)(C)CCC4(C)C)C3(C)CCCCC63C)cc2)cc1.CC(C)(C)c1ccc(-c2ccc(-c3nc4cc5c(cc4o3)B3c4ccc(C(C)(C)C)c6c4N(c4cc(C(C)(C)C)cc(c43)N5c3ccc4c(c3)C(C)(C)CCC4(C)C)C3(C)CCCCC63C)cc2)cc1.CC(C)(C)c1ccc(-c2ccc(-c3nc4cc5c(cc4s3)B3c4ccc(C(C)(C)C)c6c4N(c4cc(C(C)(C)C)cc(c43)N5c3ccc4c(c3)C(C)(C)CCC4(C)C)C3(C)CCCCC63C)cc2)cc1
InChIInChI=1S/C71H79BN4.C65H74BN3O.C65H74BN3S/c1-65(2,3)47-29-27-45(28-30-47)44-23-25-46(26-24-44)64-73-56-43-57-55(42-58(56)75(64)49-21-17-16-18-22-49)72-54-34-33-52(67(7,8)9)61-63(54)76(71(15)36-20-19-35-70(61,71)14)60-40-48(66(4,5)6)39-59(62(60)72)74(57)50-31-32-51-53(41-50)69(12,13)38-37-68(51,10)11;2*1-59(2,3)42-24-22-40(23-25-42)39-18-20-41(21-19-39)58-67-50-38-51-49(37-54(50)70-58)66-48-29-28-46(61(7,8)9)55-57(48)69(65(15)31-17-16-30-64(55,65)14)53-35-43(60(4,5)6)34-52(56(53)66)68(51)44-26-27-45-47(36-44)63(12,13)33-32-62(45,10)11/h16-18,21-34,39-43H,19-20,35-38H2,1-15H3;2*18-29,34-38H,16-17,30-33H2,1-15H3
InChIKeyRMRDIMYLXWPEIX-UHFFFAOYSA-N
XLogP48.94
TPSA76.18 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds10
Heavy Atoms216
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002863.60
LogP ≤ 548.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze 14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene?
The IUPAC name of 14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene (CID 163935763) is 14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene.
What is the SMILES notation for 14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene?
The canonical SMILES for 14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene is CC(C)(C)c1ccc(-c2ccc(-c3nc4cc5c(cc4n3-c3ccccc3)B3c4ccc(C(C)(C)C)c6c4N(c4cc(C(C)(C)C)cc(c43)N5c3ccc4c(c3)C(C)(C)CCC4(C)C)C3(C)CCCCC63C)cc2)cc1.CC(C)(C)c1ccc(-c2ccc(-c3nc4cc5c(cc4o3)B3c4ccc(C(C)(C)C)c6c4N(c4cc(C(C)(C)C)cc(c43)N5c3ccc4c(c3)C(C)(C)CCC4(C)C)C3(C)CCCCC63C)cc2)cc1.CC(C)(C)c1ccc(-c2ccc(-c3nc4cc5c(cc4s3)B3c4ccc(C(C)(C)C)c6c4N(c4cc(C(C)(C)C)cc(c43)N5c3ccc4c(c3)C(C)(C)CCC4(C)C)C3(C)CCCCC63C)cc2)cc1.
What is the InChIKey of 14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene?
The InChIKey is RMRDIMYLXWPEIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C71H79BN4.C65H74BN3O.C65H74BN3S/c1-65(2,3)47-29-27-45(28-30-47)44-23-25-46(26-24-44)64-73-56-43-57-55(42-58(56)75(64)49-21-17-16-18-22-49)72-54-34-33-52(67(7,8)9)61-63(54)76(71(15)36-20-19-35-70(61,71)14)60-40-48(66(4,5)6)39-59(62(60)72)74(57)50-31-32-51-53(41-50)69(12,13)38-37-68(51,10)11;2*1-59(2,3)42-24-22-40(23-25-42)39-18-20-41(21-19-39)58-67-50-38-51-49(37-54(50)70-58)66-48-29-28-46(61(7,8)9)55-57(48)69(65(15)31-17-16-30-64(55,65)14)53-35-43(60(4,5)6)34-52(56(53)66)68(51)44-26-27-45-47(36-44)63(12,13)33-32-62(45,10)11/h16-18,21-34,39-43H,19-20,35-38H2,1-15H3;2*18-29,34-38H,16-17,30-33H2,1-15H3.
What are the key properties of 14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene?
14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene has a molecular weight of 2863.60 g/mol, XLogP of 48.94, 10 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-5-phenyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5,7,11,17-tetraza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-oxa-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene;14,25-ditert-butyl-6-[4-(4-tert-butylphenyl)phenyl]-18,23-dimethyl-11-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-5-thia-7,11,17-triaza-1-boraoctacyclo[14.12.1.117,24.02,10.04,8.012,29.018,23.028,30]triaconta-2,4(8),6,9,12(29),13,15,24,26,28(30)-decaene is sourced from PubChem (CID 163935763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).