3-[9-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole

C222H144N12 — CID 158428603

About 3-[9-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole

3-[9-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole (PubChem CID 158428603) has the molecular formula C222H144N12 and a molecular weight of 2979.68 g/mol. Its IUPAC name is 3-[9-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole.

Molecular Properties

• Compound Name: 3-[9-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole
• PubChem CID: 158428603
• Molecular Formula: C222H144N12
• Molecular Weight: 2979.68 g/mol
• Exact Mass: 2977.16
• IUPAC Name: 3-[9-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole
• SMILES: c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)nc(-n4c5ccc(-c6ccccc6)cc5c5cc(-c6ccc7c(c6)c6cc(-c8ccccc8)ccc6n7-c6cccc7ccccc67)ccc54)c3)cc2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)nc(-n4c5ccc(-c6ccccc6)cc5c5cc(-c6ccc7c(c6)c6cc(-c8ccccc8)ccc6n7-c6cccc7ccccc67)ccc54)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-n4c5ccc(-c6ccccc6)cc5c5cc(-c6ccc7c(c6)c6cc(-c8ccccc8)ccc6n7-c6cccc7ccccc67)ccc54)n3)cc2)cc1
• InChI: InChI=1S/C75H49N3.C74H48N4.C73H47N5/c1-5-16-50(17-6-1)54-28-30-56(31-29-54)63-48-69(58-34-32-55(33-35-58)51-18-7-2-8-19-51)76-75(49-63)78-73-42-37-60(53-22-11-4-12-23-53)45-67(73)68-47-62(39-43-74(68)78)61-38-41-72-66(46-61)65-44-59(52-20-9-3-10-21-52)36-40-71(65)77(72)70-27-15-25-57-24-13-14-26-64(57)70;1-5-16-49(17-6-1)53-28-32-56(33-29-53)67-48-68(57-34-30-54(31-35-57)50-18-7-2-8-19-50)76-74(75-67)78-72-42-37-59(52-22-11-4-12-23-52)45-65(72)66-47-61(39-43-73(66)78)60-38-41-71-64(46-60)63-44-58(51-20-9-3-10-21-51)36-40-70(63)77(71)69-27-15-25-55-24-13-14-26-62(55)69;1-5-16-48(17-6-1)52-28-32-55(33-29-52)71-74-72(56-34-30-53(31-35-56)49-18-7-2-8-19-49)76-73(75-71)78-69-42-37-58(51-22-11-4-12-23-51)45-64(69)65-47-60(39-43-70(65)78)59-38-41-68-63(46-59)62-44-57(50-20-9-3-10-21-50)36-40-67(62)77(68)66-27-15-25-54-24-13-14-26-61(54)66/h1-49H;1-48H;1-47H
• InChIKey: HBJHJXVRZQOWRK-UHFFFAOYSA-N
• XLogP: 58.48
• TPSA: 106.92 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 27
• Heavy Atoms: 234
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2979.68
LogP ≤ 5	58.48
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 3-[9-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole?

The IUPAC name of 3-[9-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole (CID 158428603) is 3-[9-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole.

What is the SMILES notation for 3-[9-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole?

The canonical SMILES for 3-[9-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole is c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)nc(-n4c5ccc(-c6ccccc6)cc5c5cc(-c6ccc7c(c6)c6cc(-c8ccccc8)ccc6n7-c6cccc7ccccc67)ccc54)c3)cc2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)nc(-n4c5ccc(-c6ccccc6)cc5c5cc(-c6ccc7c(c6)c6cc(-c8ccccc8)ccc6n7-c6cccc7ccccc67)ccc54)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-n4c5ccc(-c6ccccc6)cc5c5cc(-c6ccc7c(c6)c6cc(-c8ccccc8)ccc6n7-c6cccc7ccccc67)ccc54)n3)cc2)cc1.

What is the InChIKey of 3-[9-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole?

The InChIKey is HBJHJXVRZQOWRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C75H49N3.C74H48N4.C73H47N5/c1-5-16-50(17-6-1)54-28-30-56(31-29-54)63-48-69(58-34-32-55(33-35-58)51-18-7-2-8-19-51)76-75(49-63)78-73-42-37-60(53-22-11-4-12-23-53)45-67(73)68-47-62(39-43-74(68)78)61-38-41-72-66(46-61)65-44-59(52-20-9-3-10-21-52)36-40-71(65)77(72)70-27-15-25-57-24-13-14-26-64(57)70;1-5-16-49(17-6-1)53-28-32-56(33-29-53)67-48-68(57-34-30-54(31-35-57)50-18-7-2-8-19-50)76-74(75-67)78-72-42-37-59(52-22-11-4-12-23-52)45-65(72)66-47-61(39-43-73(66)78)60-38-41-71-64(46-60)63-44-58(51-20-9-3-10-21-51)36-40-70(63)77(71)69-27-15-25-55-24-13-14-26-62(55)69;1-5-16-48(17-6-1)52-28-32-55(33-29-52)71-74-72(56-34-30-53(31-35-56)49-18-7-2-8-19-49)76-73(75-71)78-69-42-37-58(51-22-11-4-12-23-51)45-64(69)65-47-60(39-43-70(65)78)59-38-41-68-63(46-59)62-44-57(50-20-9-3-10-21-50)36-40-67(62)77(68)66-27-15-25-54-24-13-14-26-61(54)66/h1-49H;1-48H;1-47H.

What are the key properties of 3-[9-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole?

3-[9-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole has a molecular weight of 2979.68 g/mol, XLogP of 58.48, 27 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[9-[4,6-bis(4-phenylphenyl)-2-pyridinyl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-6-phenylcarbazol-3-yl]-9-naphthalen-1-yl-6-phenylcarbazole is sourced from PubChem (CID 158428603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).