3-[2,4-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;3-[3,5-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-(2-isocyanophenyl)carbazol-9-yl]-2-pyridinyl]phenyl]carbazol-3-yl]benzonitrile;9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]-3-(4-methylphenyl)carbazole

C260H160F18N26 — CID 157298808

About 3-[2,4-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;3-[3,5-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-(2-isocyanophenyl)carbazol-9-yl]-2-pyridinyl]phenyl]carbazol-3-yl]benzonitrile;9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]-3-(4-methylphenyl)carbazole

3-[2,4-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;3-[3,5-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-(2-isocyanophenyl)carbazol-9-yl]-2-pyridinyl]phenyl]carbazol-3-yl]benzonitrile;9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]-3-(4-methylphenyl)carbazole (PubChem CID 157298808) has the molecular formula C260H160F18N26 and a molecular weight of 3990.29 g/mol. Its IUPAC name is 3-[2,4-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;3-[3,5-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-(2-isocyanophenyl)carbazol-9-yl]-2-pyridinyl]phenyl]carbazol-3-yl]benzonitrile;9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]-3-(4-methylphenyl)carbazole.

Molecular Properties

• Compound Name: 3-[2,4-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;3-[3,5-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-(2-isocyanophenyl)carbazol-9-yl]-2-pyridinyl]phenyl]carbazol-3-yl]benzonitrile;9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]-3-(4-methylphenyl)carbazole
• PubChem CID: 157298808
• Molecular Formula: C260H160F18N26
• Molecular Weight: 3990.29 g/mol
• Exact Mass: 3987.30
• IUPAC Name: 3-[2,4-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;3-[3,5-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-(2-isocyanophenyl)carbazol-9-yl]-2-pyridinyl]phenyl]carbazol-3-yl]benzonitrile;9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]-3-(4-methylphenyl)carbazole
• SMILES: Cc1cc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2-c2ncccc2-n2c3ccccc3c3cc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)ccc32)cc(C(F)(F)F)c1.Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2-c2ncccc2-n2c3ccccc3c3cc(-c4ccc(C(F)(F)F)cc4C(F)(F)F)ccc32)c(C(F)(F)F)c1.Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2-c2ncccc2-n2c3ccccc3c3cc(-c4ccc(C)cc4)ccc32)cc1.[C-]#[N+]c1ccccc1-c1ccc2c(c1)c1ccccc1n2-c1cccnc1-c1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)ccc1-n1c2ccccc2c2cc(-c3ccccc3C#N)ccc21
• InChI: InChI=1S/2C66H39F9N6.C64H38N8.C64H44N6/c1-38-22-27-45(52(33-38)65(70,71)72)41-23-29-56-49(34-41)47-17-8-10-19-54(47)80(56)58-31-25-43(63-78-61(39-13-4-2-5-14-39)77-62(79-63)40-15-6-3-7-16-40)36-51(58)60-59(21-12-32-76-60)81-55-20-11-9-18-48(55)50-35-42(24-30-57(50)81)46-28-26-44(64(67,68)69)37-53(46)66(73,74)75;1-38-29-44(31-46(30-38)64(67,68)69)41-22-25-56-51(34-41)49-17-8-10-19-54(49)80(56)58-27-24-43(63-78-61(39-13-4-2-5-14-39)77-62(79-63)40-15-6-3-7-16-40)36-53(58)60-59(21-12-28-76-60)81-55-20-11-9-18-50(55)52-35-42(23-26-57(52)81)45-32-47(65(70,71)72)37-48(33-45)66(73,74)75;1-66-54-26-13-10-23-48(54)44-31-34-58-52(38-44)50-25-12-15-28-56(50)72(58)60-29-16-36-67-61(60)53-39-45(64-69-62(41-17-4-2-5-18-41)68-63(70-64)42-19-6-3-7-20-42)32-35-59(53)71-55-27-14-11-24-49(55)51-37-43(30-33-57(51)71)47-22-9-8-21-46(47)40-65;1-41-23-27-43(28-24-41)47-31-34-57-52(38-47)50-18-9-11-20-55(50)69(57)59-36-33-49(64-67-62(45-14-5-3-6-15-45)66-63(68-64)46-16-7-4-8-17-46)40-54(59)61-60(22-13-37-65-61)70-56-21-12-10-19-51(56)53-39-48(32-35-58(53)70)44-29-25-42(2)26-30-44/h2*2-37H,1H3;2-39H;3-40H,1-2H3
• InChIKey: BBQPUXCHTXZLDM-UHFFFAOYSA-N
• XLogP: 69.62
• TPSA: 273.83 Ų
• H-Bond Acceptors: 25
• Rotatable Bonds: 32
• Heavy Atoms: 304
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3990.29
LogP ≤ 5	69.62
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of 3-[2,4-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;3-[3,5-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-(2-isocyanophenyl)carbazol-9-yl]-2-pyridinyl]phenyl]carbazol-3-yl]benzonitrile;9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]-3-(4-methylphenyl)carbazole?

The IUPAC name of 3-[2,4-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;3-[3,5-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-(2-isocyanophenyl)carbazol-9-yl]-2-pyridinyl]phenyl]carbazol-3-yl]benzonitrile;9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]-3-(4-methylphenyl)carbazole (CID 157298808) is 3-[2,4-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;3-[3,5-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-(2-isocyanophenyl)carbazol-9-yl]-2-pyridinyl]phenyl]carbazol-3-yl]benzonitrile;9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]-3-(4-methylphenyl)carbazole.

What is the SMILES notation for 3-[2,4-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;3-[3,5-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-(2-isocyanophenyl)carbazol-9-yl]-2-pyridinyl]phenyl]carbazol-3-yl]benzonitrile;9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]-3-(4-methylphenyl)carbazole?

The canonical SMILES for 3-[2,4-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;3-[3,5-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-(2-isocyanophenyl)carbazol-9-yl]-2-pyridinyl]phenyl]carbazol-3-yl]benzonitrile;9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]-3-(4-methylphenyl)carbazole is Cc1cc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2-c2ncccc2-n2c3ccccc3c3cc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)ccc32)cc(C(F)(F)F)c1.Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2-c2ncccc2-n2c3ccccc3c3cc(-c4ccc(C(F)(F)F)cc4C(F)(F)F)ccc32)c(C(F)(F)F)c1.Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2-c2ncccc2-n2c3ccccc3c3cc(-c4ccc(C)cc4)ccc32)cc1.[C-]#[N+]c1ccccc1-c1ccc2c(c1)c1ccccc1n2-c1cccnc1-c1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)ccc1-n1c2ccccc2c2cc(-c3ccccc3C#N)ccc21.

What is the InChIKey of 3-[2,4-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;3-[3,5-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-(2-isocyanophenyl)carbazol-9-yl]-2-pyridinyl]phenyl]carbazol-3-yl]benzonitrile;9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]-3-(4-methylphenyl)carbazole?

The InChIKey is BBQPUXCHTXZLDM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C66H39F9N6.C64H38N8.C64H44N6/c1-38-22-27-45(52(33-38)65(70,71)72)41-23-29-56-49(34-41)47-17-8-10-19-54(47)80(56)58-31-25-43(63-78-61(39-13-4-2-5-14-39)77-62(79-63)40-15-6-3-7-16-40)36-51(58)60-59(21-12-32-76-60)81-55-20-11-9-18-48(55)50-35-42(24-30-57(50)81)46-28-26-44(64(67,68)69)37-53(46)66(73,74)75;1-38-29-44(31-46(30-38)64(67,68)69)41-22-25-56-51(34-41)49-17-8-10-19-54(49)80(56)58-27-24-43(63-78-61(39-13-4-2-5-14-39)77-62(79-63)40-15-6-3-7-16-40)36-53(58)60-59(21-12-28-76-60)81-55-20-11-9-18-50(55)52-35-42(23-26-57(52)81)45-32-47(65(70,71)72)37-48(33-45)66(73,74)75;1-66-54-26-13-10-23-48(54)44-31-34-58-52(38-44)50-25-12-15-28-56(50)72(58)60-29-16-36-67-61(60)53-39-45(64-69-62(41-17-4-2-5-18-41)68-63(70-64)42-19-6-3-7-20-42)32-35-59(53)71-55-27-14-11-24-49(55)51-37-43(30-33-57(51)71)47-22-9-8-21-46(47)40-65;1-41-23-27-43(28-24-41)47-31-34-57-52(38-47)50-18-9-11-20-55(50)69(57)59-36-33-49(64-67-62(45-14-5-3-6-15-45)66-63(68-64)46-16-7-4-8-17-46)40-54(59)61-60(22-13-37-65-61)70-56-21-12-10-19-51(56)53-39-48(32-35-58(53)70)44-29-25-42(2)26-30-44/h2*2-37H,1H3;2-39H;3-40H,1-2H3.

What are the key properties of 3-[2,4-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;3-[3,5-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-(2-isocyanophenyl)carbazol-9-yl]-2-pyridinyl]phenyl]carbazol-3-yl]benzonitrile;9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]-3-(4-methylphenyl)carbazole?

3-[2,4-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;3-[3,5-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-(2-isocyanophenyl)carbazol-9-yl]-2-pyridinyl]phenyl]carbazol-3-yl]benzonitrile;9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]-3-(4-methylphenyl)carbazole has a molecular weight of 3990.29 g/mol, XLogP of 69.62, 32 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[2,4-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;3-[3,5-bis(trifluoromethyl)phenyl]-9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]phenyl]-3-pyridinyl]carbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-[3-(2-isocyanophenyl)carbazol-9-yl]-2-pyridinyl]phenyl]carbazol-3-yl]benzonitrile;9-[2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-pyridinyl]-3-(4-methylphenyl)carbazole is sourced from PubChem (CID 157298808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).