2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole

C171H108N12O3 — CID 159623580

IUPAC2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4ccccc4-c4ccccc4)ccc3-c3ccc4c(c3)oc3cc5c6ccccc6n(-c6ccccc6)c5cc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4ccccc4-c4ccccc4)ccc3-c3ccc4oc5cc6c7ccccc7n(-c7ccccc7)c6cc5c4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4ccccc4-c4ccccc4)ccc3-c3cccc4c3oc3cc5c6ccccc6n(-c6ccccc6)c5cc34)n2)cc1
InChIInChI=1S/3C57H36N4O/c1-5-18-37(19-6-1)42-26-13-14-27-43(42)40-32-33-44(50(34-40)57-59-55(38-20-7-2-8-21-38)58-56(60-57)39-22-9-3-10-23-39)46-29-17-30-47-49-35-52-48(36-53(49)62-54(46)47)45-28-15-16-31-51(45)61(52)41-24-11-4-12-25-41;1-5-17-37(18-6-1)43-25-13-14-26-44(43)40-29-31-45(50(34-40)57-59-55(38-19-7-2-8-20-38)58-56(60-57)39-21-9-3-10-22-39)41-30-32-53-48(33-41)49-35-52-47(36-54(49)62-53)46-27-15-16-28-51(46)61(52)42-23-11-4-12-24-42;1-5-17-37(18-6-1)43-25-13-14-26-44(43)40-29-31-45(50(33-40)57-59-55(38-19-7-2-8-20-38)58-56(60-57)39-21-9-3-10-22-39)41-30-32-47-49-35-52-48(36-54(49)62-53(47)34-41)46-27-15-16-28-51(46)61(52)42-23-11-4-12-24-42/h3*1-36H
InChIKeyMOEYBFVGHMDXQY-UHFFFAOYSA-N
MW2378.83 g/mol
LogP44.61
Rot. Bonds21

About 2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole

2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole (PubChem CID 159623580) has the molecular formula C171H108N12O3 and a molecular weight of 2378.83 g/mol. Its IUPAC name is 2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole.

Molecular Properties

Compound Name2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole
PubChem CID159623580
Molecular FormulaC171H108N12O3
Molecular Weight2378.83 g/mol
Exact Mass2376.87
IUPAC Name2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4ccccc4-c4ccccc4)ccc3-c3ccc4c(c3)oc3cc5c6ccccc6n(-c6ccccc6)c5cc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4ccccc4-c4ccccc4)ccc3-c3ccc4oc5cc6c7ccccc7n(-c7ccccc7)c6cc5c4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4ccccc4-c4ccccc4)ccc3-c3cccc4c3oc3cc5c6ccccc6n(-c6ccccc6)c5cc34)n2)cc1
InChIInChI=1S/3C57H36N4O/c1-5-18-37(19-6-1)42-26-13-14-27-43(42)40-32-33-44(50(34-40)57-59-55(38-20-7-2-8-21-38)58-56(60-57)39-22-9-3-10-23-39)46-29-17-30-47-49-35-52-48(36-53(49)62-54(46)47)45-28-15-16-31-51(45)61(52)41-24-11-4-12-25-41;1-5-17-37(18-6-1)43-25-13-14-26-44(43)40-29-31-45(50(34-40)57-59-55(38-19-7-2-8-20-38)58-56(60-57)39-21-9-3-10-22-39)41-30-32-53-48(33-41)49-35-52-47(36-54(49)62-53)46-27-15-16-28-51(46)61(52)42-23-11-4-12-24-42;1-5-17-37(18-6-1)43-25-13-14-26-44(43)40-29-31-45(50(33-40)57-59-55(38-19-7-2-8-20-38)58-56(60-57)39-21-9-3-10-22-39)41-30-32-47-49-35-52-48(36-54(49)62-53(47)34-41)46-27-15-16-28-51(46)61(52)42-23-11-4-12-24-42/h3*1-36H
InChIKeyMOEYBFVGHMDXQY-UHFFFAOYSA-N
XLogP44.61
TPSA170.22 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds21
Heavy Atoms186
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002378.83
LogP ≤ 544.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole?
The IUPAC name of 2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole (CID 159623580) is 2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole.
What is the SMILES notation for 2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole?
The canonical SMILES for 2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole is c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4ccccc4-c4ccccc4)ccc3-c3ccc4c(c3)oc3cc5c6ccccc6n(-c6ccccc6)c5cc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4ccccc4-c4ccccc4)ccc3-c3ccc4oc5cc6c7ccccc7n(-c7ccccc7)c6cc5c4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4ccccc4-c4ccccc4)ccc3-c3cccc4c3oc3cc5c6ccccc6n(-c6ccccc6)c5cc34)n2)cc1.
What is the InChIKey of 2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole?
The InChIKey is MOEYBFVGHMDXQY-UHFFFAOYSA-N. The full InChI is InChI=1S/3C57H36N4O/c1-5-18-37(19-6-1)42-26-13-14-27-43(42)40-32-33-44(50(34-40)57-59-55(38-20-7-2-8-21-38)58-56(60-57)39-22-9-3-10-23-39)46-29-17-30-47-49-35-52-48(36-53(49)62-54(46)47)45-28-15-16-31-51(45)61(52)41-24-11-4-12-25-41;1-5-17-37(18-6-1)43-25-13-14-26-44(43)40-29-31-45(50(34-40)57-59-55(38-19-7-2-8-20-38)58-56(60-57)39-21-9-3-10-22-39)41-30-32-53-48(33-41)49-35-52-47(36-54(49)62-53)46-27-15-16-28-51(46)61(52)42-23-11-4-12-24-42;1-5-17-37(18-6-1)43-25-13-14-26-44(43)40-29-31-45(50(33-40)57-59-55(38-19-7-2-8-20-38)58-56(60-57)39-21-9-3-10-22-39)41-30-32-47-49-35-52-48(36-54(49)62-53(47)34-41)46-27-15-16-28-51(46)61(52)42-23-11-4-12-24-42/h3*1-36H.
What are the key properties of 2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole?
2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole has a molecular weight of 2378.83 g/mol, XLogP of 44.61, 21 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole;4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(2-phenylphenyl)phenyl]-11-phenyl-[1]benzofuro[3,2-b]carbazole is sourced from PubChem (CID 159623580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).