[4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole

C169H119N9Si — CID 159677886

IUPAC[4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole
SMILESC[Si](C)(C)c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6ccc(-c7cc(-c8ccccc8)cc(-c8ccccc8)n7)cc6)c5c4)cc32)cc1.Cc1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6cccc(-c7cc(-c8ccccc8)cc(-c8ccccc8)n7)c6)c5c4)cc32)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5ccc6c7ccccc7n(-c7cccc(-c8cc(-c9ccccc9)cc(-c9ccccc9)n8)c7)c6c5)cc43)c2)cc1
InChIInChI=1S/C59H39N3.C56H43N3Si.C54H37N3/c1-4-16-40(17-5-1)43-22-14-24-48(34-43)61-56-28-12-10-26-50(56)52-32-30-44(38-58(52)61)45-31-33-53-51-27-11-13-29-57(51)62(59(53)39-45)49-25-15-23-46(35-49)55-37-47(41-18-6-2-7-19-41)36-54(60-55)42-20-8-3-9-21-42;1-60(2,3)46-30-28-45(29-31-46)59-54-21-13-11-19-48(54)50-33-25-42(37-56(50)59)41-24-32-49-47-18-10-12-20-53(47)58(55(49)36-41)44-26-22-40(23-27-44)52-35-43(38-14-6-4-7-15-38)34-51(57-52)39-16-8-5-9-17-39;1-36-23-27-43(28-24-36)56-51-21-10-8-19-45(51)47-29-25-39(34-53(47)56)40-26-30-48-46-20-9-11-22-52(46)57(54(48)35-40)44-18-12-17-41(31-44)50-33-42(37-13-4-2-5-14-37)32-49(55-50)38-15-6-3-7-16-38/h1-39H;4-37H,1-3H3;2-35H,1H3
InChIKeyMUVLRUQAGNDEJX-UHFFFAOYSA-N
MW2303.96 g/mol
LogP44.35
Rot. Bonds20

About [4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole

[4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole (PubChem CID 159677886) has the molecular formula C169H119N9Si and a molecular weight of 2303.96 g/mol. Its IUPAC name is [4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole.

Molecular Properties

Compound Name[4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole
PubChem CID159677886
Molecular FormulaC169H119N9Si
Molecular Weight2303.96 g/mol
Exact Mass2301.94
IUPAC Name[4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole
SMILESC[Si](C)(C)c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6ccc(-c7cc(-c8ccccc8)cc(-c8ccccc8)n7)cc6)c5c4)cc32)cc1.Cc1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6cccc(-c7cc(-c8ccccc8)cc(-c8ccccc8)n7)c6)c5c4)cc32)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5ccc6c7ccccc7n(-c7cccc(-c8cc(-c9ccccc9)cc(-c9ccccc9)n8)c7)c6c5)cc43)c2)cc1
InChIInChI=1S/C59H39N3.C56H43N3Si.C54H37N3/c1-4-16-40(17-5-1)43-22-14-24-48(34-43)61-56-28-12-10-26-50(56)52-32-30-44(38-58(52)61)45-31-33-53-51-27-11-13-29-57(51)62(59(53)39-45)49-25-15-23-46(35-49)55-37-47(41-18-6-2-7-19-41)36-54(60-55)42-20-8-3-9-21-42;1-60(2,3)46-30-28-45(29-31-46)59-54-21-13-11-19-48(54)50-33-25-42(37-56(50)59)41-24-32-49-47-18-10-12-20-53(47)58(55(49)36-41)44-26-22-40(23-27-44)52-35-43(38-14-6-4-7-15-38)34-51(57-52)39-16-8-5-9-17-39;1-36-23-27-43(28-24-36)56-51-21-10-8-19-45(51)47-29-25-39(34-53(47)56)40-26-30-48-46-20-9-11-22-52(46)57(54(48)35-40)44-18-12-17-41(31-44)50-33-42(37-13-4-2-5-14-37)32-49(55-50)38-15-6-3-7-16-38/h1-39H;4-37H,1-3H3;2-35H,1H3
InChIKeyMUVLRUQAGNDEJX-UHFFFAOYSA-N
XLogP44.35
TPSA68.25 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds20
Heavy Atoms179
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002303.96
LogP ≤ 544.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze [4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of [4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole?
The IUPAC name of [4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole (CID 159677886) is [4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole.
What is the SMILES notation for [4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole?
The canonical SMILES for [4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole is C[Si](C)(C)c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6ccc(-c7cc(-c8ccccc8)cc(-c8ccccc8)n7)cc6)c5c4)cc32)cc1.Cc1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6cccc(-c7cc(-c8ccccc8)cc(-c8ccccc8)n7)c6)c5c4)cc32)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5ccc6c7ccccc7n(-c7cccc(-c8cc(-c9ccccc9)cc(-c9ccccc9)n8)c7)c6c5)cc43)c2)cc1.
What is the InChIKey of [4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole?
The InChIKey is MUVLRUQAGNDEJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H39N3.C56H43N3Si.C54H37N3/c1-4-16-40(17-5-1)43-22-14-24-48(34-43)61-56-28-12-10-26-50(56)52-32-30-44(38-58(52)61)45-31-33-53-51-27-11-13-29-57(51)62(59(53)39-45)49-25-15-23-46(35-49)55-37-47(41-18-6-2-7-19-41)36-54(60-55)42-20-8-3-9-21-42;1-60(2,3)46-30-28-45(29-31-46)59-54-21-13-11-19-48(54)50-33-25-42(37-56(50)59)41-24-32-49-47-18-10-12-20-53(47)58(55(49)36-41)44-26-22-40(23-27-44)52-35-43(38-14-6-4-7-15-38)34-51(57-52)39-16-8-5-9-17-39;1-36-23-27-43(28-24-36)56-51-21-10-8-19-45(51)47-29-25-39(34-53(47)56)40-26-30-48-46-20-9-11-22-52(46)57(54(48)35-40)44-18-12-17-41(31-44)50-33-42(37-13-4-2-5-14-37)32-49(55-50)38-15-6-3-7-16-38/h1-39H;4-37H,1-3H3;2-35H,1H3.
What are the key properties of [4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole?
[4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole has a molecular weight of 2303.96 g/mol, XLogP of 44.35, 20 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]carbazol-9-yl]phenyl]-trimethylsilane;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(4-methylphenyl)carbazole;2-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-(3-phenylphenyl)carbazole is sourced from PubChem (CID 159677886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).