3-[5-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]carbazole;4-[4-phenyl-5-(9-phenylcarbazol-3-yl)-1,2,4-triazol-3-yl]-9-(6-pyridin-3-yl-2-pyridinyl)carbazole

C288H185N41 — CID 161182261

About 3-[5-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]carbazole;4-[4-phenyl-5-(9-phenylcarbazol-3-yl)-1,2,4-triazol-3-yl]-9-(6-pyridin-3-yl-2-pyridinyl)carbazole

3-[5-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]carbazole;4-[4-phenyl-5-(9-phenylcarbazol-3-yl)-1,2,4-triazol-3-yl]-9-(6-pyridin-3-yl-2-pyridinyl)carbazole (PubChem CID 161182261) has the molecular formula C288H185N41 and a molecular weight of 4219.93 g/mol. Its IUPAC name is 3-[5-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]carbazole;4-[4-phenyl-5-(9-phenylcarbazol-3-yl)-1,2,4-triazol-3-yl]-9-(6-pyridin-3-yl-2-pyridinyl)carbazole.

Molecular Properties

• Compound Name: 3-[5-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]carbazole;4-[4-phenyl-5-(9-phenylcarbazol-3-yl)-1,2,4-triazol-3-yl]-9-(6-pyridin-3-yl-2-pyridinyl)carbazole
• PubChem CID: 161182261
• Molecular Formula: C288H185N41
• Molecular Weight: 4219.93 g/mol
• Exact Mass: 4216.57
• IUPAC Name: 3-[5-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]carbazole;4-[4-phenyl-5-(9-phenylcarbazol-3-yl)-1,2,4-triazol-3-yl]-9-(6-pyridin-3-yl-2-pyridinyl)carbazole
• SMILES: c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4c(-c5nnc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)n5-c5ccccc5)cccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5c(-c6nnc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)n6-c6ccccc6)cccc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc(-c6nnc(-c7cccc8c7c7ccccc7n8-c7cccc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c7)n6-c6ccccc6)ccc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4c(-c5nnc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)n5-c5ccccc5)cccc43)n2)cc1.c1ccc(-n2c(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nnc2-c2cccc3c2c2ccccc2n3-c2cccc(-c3cccnc3)n2)cc1
• InChI: InChI=1S/C74H47N11.C59H38N8.C54H35N7.C53H34N8.C48H31N7/c1-6-23-48(24-7-1)67-75-68(49-25-8-2-9-26-49)78-71(77-67)52-31-20-35-56(45-52)83-62-40-18-16-37-58(62)61-47-54(43-44-64(61)83)73-81-82-74(85(73)55-33-14-5-15-34-55)60-39-22-42-65-66(60)59-38-17-19-41-63(59)84(65)57-36-21-32-53(46-57)72-79-69(50-27-10-3-11-28-50)76-70(80-72)51-29-12-4-13-30-51;1-5-19-39(20-6-1)55-60-56(40-21-7-2-8-22-40)62-57(61-55)41-23-17-28-45(37-41)66-51-33-16-14-30-47(51)54-48(31-18-34-53(54)66)59-64-63-58(67(59)44-26-11-4-12-27-44)42-35-36-52-49(38-42)46-29-13-15-32-50(46)65(52)43-24-9-3-10-25-43;1-5-18-36(19-6-1)45-35-46(37-20-7-2-8-21-37)56-54(55-45)61-48-30-16-14-27-42(48)51-43(28-17-31-50(51)61)53-58-57-52(60(53)40-24-11-4-12-25-40)38-32-33-49-44(34-38)41-26-13-15-29-47(41)59(49)39-22-9-3-10-23-39;1-5-18-35(19-6-1)49-54-50(36-20-7-2-8-21-36)56-53(55-49)61-45-30-16-14-27-41(45)48-42(28-17-31-47(48)61)52-58-57-51(60(52)39-24-11-4-12-25-39)37-32-33-46-43(34-37)40-26-13-15-29-44(40)59(46)38-22-9-3-10-23-38;1-3-15-34(16-4-1)53-41-23-9-7-19-36(41)39-30-32(27-28-43(39)53)47-51-52-48(54(47)35-17-5-2-6-18-35)38-21-11-25-44-46(38)37-20-8-10-24-42(37)55(44)45-26-12-22-40(50-45)33-14-13-29-49-31-33/h1-47H;1-38H;1-35H;1-34H;1-31H
• InChIKey: USPTZVNPQRYSTP-UHFFFAOYSA-N
• XLogP: 67.64
• TPSA: 409.09 Ų
• H-Bond Acceptors: 41
• Rotatable Bonds: 39
• Heavy Atoms: 329
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4219.93
LogP ≤ 5	67.64
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	41

Frequently Asked Questions

What is the IUPAC name of 3-[5-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]carbazole;4-[4-phenyl-5-(9-phenylcarbazol-3-yl)-1,2,4-triazol-3-yl]-9-(6-pyridin-3-yl-2-pyridinyl)carbazole?

The IUPAC name of 3-[5-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]carbazole;4-[4-phenyl-5-(9-phenylcarbazol-3-yl)-1,2,4-triazol-3-yl]-9-(6-pyridin-3-yl-2-pyridinyl)carbazole (CID 161182261) is 3-[5-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]carbazole;4-[4-phenyl-5-(9-phenylcarbazol-3-yl)-1,2,4-triazol-3-yl]-9-(6-pyridin-3-yl-2-pyridinyl)carbazole.

What is the SMILES notation for 3-[5-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]carbazole;4-[4-phenyl-5-(9-phenylcarbazol-3-yl)-1,2,4-triazol-3-yl]-9-(6-pyridin-3-yl-2-pyridinyl)carbazole?

The canonical SMILES for 3-[5-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]carbazole;4-[4-phenyl-5-(9-phenylcarbazol-3-yl)-1,2,4-triazol-3-yl]-9-(6-pyridin-3-yl-2-pyridinyl)carbazole is c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4c(-c5nnc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)n5-c5ccccc5)cccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5c(-c6nnc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)n6-c6ccccc6)cccc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc(-c6nnc(-c7cccc8c7c7ccccc7n8-c7cccc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c7)n6-c6ccccc6)ccc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4c(-c5nnc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)n5-c5ccccc5)cccc43)n2)cc1.c1ccc(-n2c(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nnc2-c2cccc3c2c2ccccc2n3-c2cccc(-c3cccnc3)n2)cc1.

What is the InChIKey of 3-[5-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]carbazole;4-[4-phenyl-5-(9-phenylcarbazol-3-yl)-1,2,4-triazol-3-yl]-9-(6-pyridin-3-yl-2-pyridinyl)carbazole?

The InChIKey is USPTZVNPQRYSTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H47N11.C59H38N8.C54H35N7.C53H34N8.C48H31N7/c1-6-23-48(24-7-1)67-75-68(49-25-8-2-9-26-49)78-71(77-67)52-31-20-35-56(45-52)83-62-40-18-16-37-58(62)61-47-54(43-44-64(61)83)73-81-82-74(85(73)55-33-14-5-15-34-55)60-39-22-42-65-66(60)59-38-17-19-41-63(59)84(65)57-36-21-32-53(46-57)72-79-69(50-27-10-3-11-28-50)76-70(80-72)51-29-12-4-13-30-51;1-5-19-39(20-6-1)55-60-56(40-21-7-2-8-22-40)62-57(61-55)41-23-17-28-45(37-41)66-51-33-16-14-30-47(51)54-48(31-18-34-53(54)66)59-64-63-58(67(59)44-26-11-4-12-27-44)42-35-36-52-49(38-42)46-29-13-15-32-50(46)65(52)43-24-9-3-10-25-43;1-5-18-36(19-6-1)45-35-46(37-20-7-2-8-21-37)56-54(55-45)61-48-30-16-14-27-42(48)51-43(28-17-31-50(51)61)53-58-57-52(60(53)40-24-11-4-12-25-40)38-32-33-49-44(34-38)41-26-13-15-29-47(41)59(49)39-22-9-3-10-23-39;1-5-18-35(19-6-1)49-54-50(36-20-7-2-8-21-36)56-53(55-49)61-45-30-16-14-27-41(45)48-42(28-17-31-47(48)61)52-58-57-51(60(52)39-24-11-4-12-25-39)37-32-33-46-43(34-37)40-26-13-15-29-44(40)59(46)38-22-9-3-10-23-38;1-3-15-34(16-4-1)53-41-23-9-7-19-36(41)39-30-32(27-28-43(39)53)47-51-52-48(54(47)35-17-5-2-6-18-35)38-21-11-25-44-46(38)37-20-8-10-24-42(37)55(44)45-26-12-22-40(50-45)33-14-13-29-49-31-33/h1-47H;1-38H;1-35H;1-34H;1-31H.

What are the key properties of 3-[5-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]carbazole;4-[4-phenyl-5-(9-phenylcarbazol-3-yl)-1,2,4-triazol-3-yl]-9-(6-pyridin-3-yl-2-pyridinyl)carbazole?

3-[5-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]carbazole;4-[4-phenyl-5-(9-phenylcarbazol-3-yl)-1,2,4-triazol-3-yl]-9-(6-pyridin-3-yl-2-pyridinyl)carbazole has a molecular weight of 4219.93 g/mol, XLogP of 67.64, 39 rotatable bonds, 0 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[5-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]-9-phenylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[5-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-4-phenyl-1,2,4-triazol-3-yl]carbazole;4-[4-phenyl-5-(9-phenylcarbazol-3-yl)-1,2,4-triazol-3-yl]-9-(6-pyridin-3-yl-2-pyridinyl)carbazole is sourced from PubChem (CID 161182261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).