6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline

C132H86N11OP — CID 159236321

IUPAC6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline
SMILESO=P(c1ccccc1)(c1ccccc1)c1ccc(-c2nc3ccccc3c3c4ccccc4n(-c4ccccc4)c23)cc1.c1ccc(-c2cc(-c3ccc(-c4nc5ccccc5c5c6ccccc6n(-c6ccccc6)c45)c4ccccc34)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4nc5ccccc5c5c6ccccc6n(-c6ccccc6)c45)c4ccccc34)n2)cc1
InChIInChI=1S/C47H30N4.C46H29N5.C39H27N2OP/c1-4-16-31(17-5-1)41-30-42(50-47(49-41)32-18-6-2-7-19-32)36-28-29-37(35-23-11-10-22-34(35)36)45-46-44(38-24-12-14-26-40(38)48-45)39-25-13-15-27-43(39)51(46)33-20-8-3-9-21-33;1-4-16-30(17-5-1)44-48-45(31-18-6-2-7-19-31)50-46(49-44)36-29-28-35(33-22-10-11-23-34(33)36)42-43-41(37-24-12-14-26-39(37)47-42)38-25-13-15-27-40(38)51(43)32-20-8-3-9-21-32;42-43(30-16-6-2-7-17-30,31-18-8-3-9-19-31)32-26-24-28(25-27-32)38-39-37(33-20-10-12-22-35(33)40-38)34-21-11-13-23-36(34)41(39)29-14-4-1-5-15-29/h1-30H;1-29H;1-27H
InChIKeyKTNCBPZLMUMGHT-UHFFFAOYSA-N
MW1873.19 g/mol
LogP31.92
Rot. Bonds15

About 6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline

6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline (PubChem CID 159236321) has the molecular formula C132H86N11OP and a molecular weight of 1873.19 g/mol. Its IUPAC name is 6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline.

Molecular Properties

Compound Name6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline
PubChem CID159236321
Molecular FormulaC132H86N11OP
Molecular Weight1873.19 g/mol
Exact Mass1871.68
IUPAC Name6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline
SMILESO=P(c1ccccc1)(c1ccccc1)c1ccc(-c2nc3ccccc3c3c4ccccc4n(-c4ccccc4)c23)cc1.c1ccc(-c2cc(-c3ccc(-c4nc5ccccc5c5c6ccccc6n(-c6ccccc6)c45)c4ccccc34)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4nc5ccccc5c5c6ccccc6n(-c6ccccc6)c45)c4ccccc34)n2)cc1
InChIInChI=1S/C47H30N4.C46H29N5.C39H27N2OP/c1-4-16-31(17-5-1)41-30-42(50-47(49-41)32-18-6-2-7-19-32)36-28-29-37(35-23-11-10-22-34(35)36)45-46-44(38-24-12-14-26-40(38)48-45)39-25-13-15-27-43(39)51(46)33-20-8-3-9-21-33;1-4-16-30(17-5-1)44-48-45(31-18-6-2-7-19-31)50-46(49-44)36-29-28-35(33-22-10-11-23-34(33)36)42-43-41(37-24-12-14-26-39(37)47-42)38-25-13-15-27-40(38)51(43)32-20-8-3-9-21-32;42-43(30-16-6-2-7-17-30,31-18-8-3-9-19-31)32-26-24-28(25-27-32)38-39-37(33-20-10-12-22-35(33)40-38)34-21-11-13-23-36(34)41(39)29-14-4-1-5-15-29/h1-30H;1-29H;1-27H
InChIKeyKTNCBPZLMUMGHT-UHFFFAOYSA-N
XLogP31.92
TPSA134.98 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds15
Heavy Atoms145
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001873.19
LogP ≤ 531.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze 6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline?
The IUPAC name of 6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline (CID 159236321) is 6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline.
What is the SMILES notation for 6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline?
The canonical SMILES for 6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline is O=P(c1ccccc1)(c1ccccc1)c1ccc(-c2nc3ccccc3c3c4ccccc4n(-c4ccccc4)c23)cc1.c1ccc(-c2cc(-c3ccc(-c4nc5ccccc5c5c6ccccc6n(-c6ccccc6)c45)c4ccccc34)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4nc5ccccc5c5c6ccccc6n(-c6ccccc6)c45)c4ccccc34)n2)cc1.
What is the InChIKey of 6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline?
The InChIKey is KTNCBPZLMUMGHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H30N4.C46H29N5.C39H27N2OP/c1-4-16-31(17-5-1)41-30-42(50-47(49-41)32-18-6-2-7-19-32)36-28-29-37(35-23-11-10-22-34(35)36)45-46-44(38-24-12-14-26-40(38)48-45)39-25-13-15-27-43(39)51(46)33-20-8-3-9-21-33;1-4-16-30(17-5-1)44-48-45(31-18-6-2-7-19-31)50-46(49-44)36-29-28-35(33-22-10-11-23-34(33)36)42-43-41(37-24-12-14-26-39(37)47-42)38-25-13-15-27-40(38)51(43)32-20-8-3-9-21-32;42-43(30-16-6-2-7-17-30,31-18-8-3-9-19-31)32-26-24-28(25-27-32)38-39-37(33-20-10-12-22-35(33)40-38)34-21-11-13-23-36(34)41(39)29-14-4-1-5-15-29/h1-30H;1-29H;1-27H.
What are the key properties of 6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline?
6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline has a molecular weight of 1873.19 g/mol, XLogP of 31.92, 15 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline is sourced from PubChem (CID 159236321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).