3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole

C255H161N21 — CID 159326922

IUPAC3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole
SMILESc1ccc(-c2nc(-c3cccc(-c4ccc(-c5ccc(-n6c7ccccc7c7cc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc76)cc5)c(-n5c6ccccc6c6ccccc65)c4)c3)nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)c(-c5ccc(-n6c7ccccc7c7cc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc76)cc5)c4)c3)nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)c(-n5c6ccccc6c6cc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)ccc65)c4)c3)nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)cc1
InChIInChI=1S/2C87H55N7.C81H51N7/c1-3-21-57(22-4-1)85-88-86(90-87(89-85)63-25-20-28-66(52-63)93-76-35-13-7-29-68(76)69-30-8-14-36-77(69)93)62-24-19-23-58(51-62)61-43-48-67(84(55-61)94-80-39-17-9-31-70(80)71-32-10-18-40-81(71)94)56-41-46-65(47-42-56)92-79-38-16-12-34-73(79)75-54-60(45-50-83(75)92)59-44-49-82-74(53-59)72-33-11-15-37-78(72)91(82)64-26-5-2-6-27-64;1-3-21-57(22-4-1)85-88-86(90-87(89-85)63-25-20-28-66(52-63)93-76-35-13-7-29-67(76)68-30-8-14-36-77(68)93)62-24-19-23-58(51-62)59-43-48-82(94-80-39-17-9-31-69(80)70-32-10-18-40-81(70)94)73(53-59)56-41-46-65(47-42-56)92-79-38-16-12-34-72(79)75-55-61(45-50-84(75)92)60-44-49-83-74(54-60)71-33-11-15-37-78(71)91(83)64-26-5-2-6-27-64;1-3-21-52(22-4-1)79-82-80(84-81(83-79)58-25-20-28-60(48-58)86-69-35-13-7-29-61(69)62-30-8-14-36-70(62)86)57-24-19-23-53(47-57)56-43-46-77(87-72-38-16-9-31-63(72)64-32-10-17-39-73(64)87)78(51-56)88-74-40-18-12-34-66(74)68-50-55(42-45-76(68)88)54-41-44-75-67(49-54)65-33-11-15-37-71(65)85(75)59-26-5-2-6-27-59/h2*1-55H;1-51H
InChIKeyLEMBSSDZBOPJDK-UHFFFAOYSA-N
MW3519.24 g/mol
LogP65.12
Rot. Bonds29

About 3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole

3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole (PubChem CID 159326922) has the molecular formula C255H161N21 and a molecular weight of 3519.24 g/mol. Its IUPAC name is 3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole
PubChem CID159326922
Molecular FormulaC255H161N21
Molecular Weight3519.24 g/mol
Exact Mass3516.32
IUPAC Name3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole
SMILESc1ccc(-c2nc(-c3cccc(-c4ccc(-c5ccc(-n6c7ccccc7c7cc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc76)cc5)c(-n5c6ccccc6c6ccccc65)c4)c3)nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)c(-c5ccc(-n6c7ccccc7c7cc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc76)cc5)c4)c3)nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)c(-n5c6ccccc6c6cc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)ccc65)c4)c3)nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)cc1
InChIInChI=1S/2C87H55N7.C81H51N7/c1-3-21-57(22-4-1)85-88-86(90-87(89-85)63-25-20-28-66(52-63)93-76-35-13-7-29-68(76)69-30-8-14-36-77(69)93)62-24-19-23-58(51-62)61-43-48-67(84(55-61)94-80-39-17-9-31-70(80)71-32-10-18-40-81(71)94)56-41-46-65(47-42-56)92-79-38-16-12-34-73(79)75-54-60(45-50-83(75)92)59-44-49-82-74(53-59)72-33-11-15-37-78(72)91(82)64-26-5-2-6-27-64;1-3-21-57(22-4-1)85-88-86(90-87(89-85)63-25-20-28-66(52-63)93-76-35-13-7-29-67(76)68-30-8-14-36-77(68)93)62-24-19-23-58(51-62)59-43-48-82(94-80-39-17-9-31-69(80)70-32-10-18-40-81(70)94)73(53-59)56-41-46-65(47-42-56)92-79-38-16-12-34-72(79)75-55-61(45-50-84(75)92)60-44-49-83-74(54-60)71-33-11-15-37-78(71)91(83)64-26-5-2-6-27-64;1-3-21-52(22-4-1)79-82-80(84-81(83-79)58-25-20-28-60(48-58)86-69-35-13-7-29-61(69)62-30-8-14-36-70(62)86)57-24-19-23-53(47-57)56-43-46-77(87-72-38-16-9-31-63(72)64-32-10-17-39-73(64)87)78(51-56)88-74-40-18-12-34-66(74)68-50-55(42-45-76(68)88)54-41-44-75-67(49-54)65-33-11-15-37-71(65)85(75)59-26-5-2-6-27-59/h2*1-55H;1-51H
InChIKeyLEMBSSDZBOPJDK-UHFFFAOYSA-N
XLogP65.12
TPSA175.17 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds29
Heavy Atoms276
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003519.24
LogP ≤ 565.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Analyze 3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole?
The IUPAC name of 3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole (CID 159326922) is 3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole.
What is the SMILES notation for 3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole?
The canonical SMILES for 3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole is c1ccc(-c2nc(-c3cccc(-c4ccc(-c5ccc(-n6c7ccccc7c7cc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc76)cc5)c(-n5c6ccccc6c6ccccc65)c4)c3)nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)c(-c5ccc(-n6c7ccccc7c7cc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc76)cc5)c4)c3)nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)c(-n5c6ccccc6c6cc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)ccc65)c4)c3)nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)cc1.
What is the InChIKey of 3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole?
The InChIKey is LEMBSSDZBOPJDK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C87H55N7.C81H51N7/c1-3-21-57(22-4-1)85-88-86(90-87(89-85)63-25-20-28-66(52-63)93-76-35-13-7-29-68(76)69-30-8-14-36-77(69)93)62-24-19-23-58(51-62)61-43-48-67(84(55-61)94-80-39-17-9-31-70(80)71-32-10-18-40-81(71)94)56-41-46-65(47-42-56)92-79-38-16-12-34-73(79)75-54-60(45-50-83(75)92)59-44-49-82-74(53-59)72-33-11-15-37-78(72)91(82)64-26-5-2-6-27-64;1-3-21-57(22-4-1)85-88-86(90-87(89-85)63-25-20-28-66(52-63)93-76-35-13-7-29-67(76)68-30-8-14-36-77(68)93)62-24-19-23-58(51-62)59-43-48-82(94-80-39-17-9-31-69(80)70-32-10-18-40-81(70)94)73(53-59)56-41-46-65(47-42-56)92-79-38-16-12-34-72(79)75-55-61(45-50-84(75)92)60-44-49-83-74(54-60)71-33-11-15-37-78(71)91(83)64-26-5-2-6-27-64;1-3-21-52(22-4-1)79-82-80(84-81(83-79)58-25-20-28-60(48-58)86-69-35-13-7-29-61(69)62-30-8-14-36-70(62)86)57-24-19-23-53(47-57)56-43-46-77(87-72-38-16-9-31-63(72)64-32-10-17-39-73(64)87)78(51-56)88-74-40-18-12-34-66(74)68-50-55(42-45-76(68)88)54-41-44-75-67(49-54)65-33-11-15-37-71(65)85(75)59-26-5-2-6-27-59/h2*1-55H;1-51H.
What are the key properties of 3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole?
3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole has a molecular weight of 3519.24 g/mol, XLogP of 65.12, 29 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[2-carbazol-9-yl-5-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole is sourced from PubChem (CID 159326922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).