2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole

C189H117N15O3 — CID 160833740

IUPAC2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5c(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5c(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5c(-c6cccc7c6c6ccccc6n7-c6ccccc6)cc(-c6cccc7c6c6ccccc6n7-c6ccccc6)cc5c34)n2)cc1
InChIInChI=1S/3C63H39N5O/c1-5-20-40(21-6-1)61-64-62(41-22-7-2-8-23-41)66-63(65-61)49-32-19-37-56-59(49)51-39-42(45-30-17-35-54-57(45)47-28-13-15-33-52(47)67(54)43-24-9-3-10-25-43)38-50(60(51)69-56)46-31-18-36-55-58(46)48-29-14-16-34-53(48)68(55)44-26-11-4-12-27-44;1-5-18-40(19-6-1)61-64-62(41-20-7-2-8-21-41)66-63(65-61)51-28-17-31-58-59(51)53-37-44(42-32-34-49-47-26-13-15-29-54(47)67(56(49)38-42)45-22-9-3-10-23-45)36-52(60(53)69-58)43-33-35-50-48-27-14-16-30-55(48)68(57(50)39-43)46-24-11-4-12-25-46;1-5-18-40(19-6-1)61-64-62(41-20-7-2-8-21-41)66-63(65-61)49-28-17-31-58-59(49)53-39-44(42-32-34-56-51(36-42)47-26-13-15-29-54(47)67(56)45-22-9-3-10-23-45)38-50(60(53)69-58)43-33-35-57-52(37-43)48-27-14-16-30-55(48)68(57)46-24-11-4-12-25-46/h3*1-39H
InChIKeySHDIJJBQFOMWGR-UHFFFAOYSA-N
MW2646.12 g/mol
LogP48.90
Rot. Bonds21

About 2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole

2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole (PubChem CID 160833740) has the molecular formula C189H117N15O3 and a molecular weight of 2646.12 g/mol. Its IUPAC name is 2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole
PubChem CID160833740
Molecular FormulaC189H117N15O3
Molecular Weight2646.12 g/mol
Exact Mass2643.95
IUPAC Name2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5c(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5c(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5c(-c6cccc7c6c6ccccc6n7-c6ccccc6)cc(-c6cccc7c6c6ccccc6n7-c6ccccc6)cc5c34)n2)cc1
InChIInChI=1S/3C63H39N5O/c1-5-20-40(21-6-1)61-64-62(41-22-7-2-8-23-41)66-63(65-61)49-32-19-37-56-59(49)51-39-42(45-30-17-35-54-57(45)47-28-13-15-33-52(47)67(54)43-24-9-3-10-25-43)38-50(60(51)69-56)46-31-18-36-55-58(46)48-29-14-16-34-53(48)68(55)44-26-11-4-12-27-44;1-5-18-40(19-6-1)61-64-62(41-20-7-2-8-21-41)66-63(65-61)51-28-17-31-58-59(51)53-37-44(42-32-34-49-47-26-13-15-29-54(47)67(56(49)38-42)45-22-9-3-10-23-45)36-52(60(53)69-58)43-33-35-50-48-27-14-16-30-55(48)68(57(50)39-43)46-24-11-4-12-25-46;1-5-18-40(19-6-1)61-64-62(41-20-7-2-8-21-41)66-63(65-61)49-28-17-31-58-59(49)53-39-44(42-32-34-56-51(36-42)47-26-13-15-29-54(47)67(56)45-22-9-3-10-23-45)38-50(60(53)69-58)43-33-35-57-52(37-43)48-27-14-16-30-55(48)68(57)46-24-11-4-12-25-46/h3*1-39H
InChIKeySHDIJJBQFOMWGR-UHFFFAOYSA-N
XLogP48.90
TPSA185.01 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds21
Heavy Atoms207
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002646.12
LogP ≤ 548.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole?
The IUPAC name of 2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole (CID 160833740) is 2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole.
What is the SMILES notation for 2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole?
The canonical SMILES for 2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole is c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5c(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5c(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5c(-c6cccc7c6c6ccccc6n7-c6ccccc6)cc(-c6cccc7c6c6ccccc6n7-c6ccccc6)cc5c34)n2)cc1.
What is the InChIKey of 2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole?
The InChIKey is SHDIJJBQFOMWGR-UHFFFAOYSA-N. The full InChI is InChI=1S/3C63H39N5O/c1-5-20-40(21-6-1)61-64-62(41-22-7-2-8-23-41)66-63(65-61)49-32-19-37-56-59(49)51-39-42(45-30-17-35-54-57(45)47-28-13-15-33-52(47)67(54)43-24-9-3-10-25-43)38-50(60(51)69-56)46-31-18-36-55-58(46)48-29-14-16-34-53(48)68(55)44-26-11-4-12-27-44;1-5-18-40(19-6-1)61-64-62(41-20-7-2-8-21-41)66-63(65-61)51-28-17-31-58-59(51)53-37-44(42-32-34-49-47-26-13-15-29-54(47)67(56(49)38-42)45-22-9-3-10-23-45)36-52(60(53)69-58)43-33-35-50-48-27-14-16-30-55(48)68(57(50)39-43)46-24-11-4-12-25-46;1-5-18-40(19-6-1)61-64-62(41-20-7-2-8-21-41)66-63(65-61)49-28-17-31-58-59(49)53-39-44(42-32-34-56-51(36-42)47-26-13-15-29-54(47)67(56)45-22-9-3-10-23-45)38-50(60(53)69-58)43-33-35-57-52(37-43)48-27-14-16-30-55(48)68(57)46-24-11-4-12-25-46/h3*1-39H.
What are the key properties of 2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole?
2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole has a molecular weight of 2646.12 g/mol, XLogP of 48.90, 21 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]-9-phenylcarbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(9-phenylcarbazol-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole is sourced from PubChem (CID 160833740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).