2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine

C169H101N9O3 — CID 164971653

IUPAC2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccc(-c4c(-c5cccc6ccccc56)ccc5oc6cc7ccccc7cc6c45)cc3)nc(-c3cccc4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccc4ccc5ccccc5c4c3)nc(-c3ccc(-c4c(-c5cccc6ccccc56)ccc5oc6cc7ccccc7cc6c45)c4ccccc34)n2)cc1.c1ccc2cc(-c3ccc4oc5cc6ccccc6cc5c4c3-c3ccc(-c4nc(-c5cccc6ccccc56)nc(-c5cccc6ccccc56)n4)c4ccccc34)ccc2c1
InChIInChI=1S/2C59H35N3O.C51H31N3O/c1-2-16-39-33-42(28-27-36(39)13-1)45-31-32-53-56(52-34-40-17-3-4-18-41(40)35-54(52)63-53)55(45)48-29-30-51(47-24-10-9-23-46(47)48)59-61-57(49-25-11-19-37-14-5-7-21-43(37)49)60-58(62-59)50-26-12-20-38-15-6-8-22-44(38)50;1-2-15-39(16-3-1)57-60-58(42-28-27-38-26-25-37-14-7-9-21-44(37)51(38)34-42)62-59(61-57)50-30-29-48(46-22-10-11-23-47(46)50)55-49(45-24-12-19-36-13-6-8-20-43(36)45)31-32-53-56(55)52-33-40-17-4-5-18-41(40)35-54(52)63-53;1-2-14-35(15-3-1)49-52-50(54-51(53-49)43-23-11-19-33-13-7-9-21-40(33)43)36-26-24-34(25-27-36)47-42(41-22-10-18-32-12-6-8-20-39(32)41)28-29-45-48(47)44-30-37-16-4-5-17-38(37)31-46(44)55-45/h2*1-35H;1-31H
InChIKeyDEYRISFZQVIZRJ-UHFFFAOYSA-N
MW2305.73 g/mol
LogP45.31
Rot. Bonds15

About 2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine

2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine (PubChem CID 164971653) has the molecular formula C169H101N9O3 and a molecular weight of 2305.73 g/mol. Its IUPAC name is 2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine
PubChem CID164971653
Molecular FormulaC169H101N9O3
Molecular Weight2305.73 g/mol
Exact Mass2303.80
IUPAC Name2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccc(-c4c(-c5cccc6ccccc56)ccc5oc6cc7ccccc7cc6c45)cc3)nc(-c3cccc4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccc4ccc5ccccc5c4c3)nc(-c3ccc(-c4c(-c5cccc6ccccc56)ccc5oc6cc7ccccc7cc6c45)c4ccccc34)n2)cc1.c1ccc2cc(-c3ccc4oc5cc6ccccc6cc5c4c3-c3ccc(-c4nc(-c5cccc6ccccc56)nc(-c5cccc6ccccc56)n4)c4ccccc34)ccc2c1
InChIInChI=1S/2C59H35N3O.C51H31N3O/c1-2-16-39-33-42(28-27-36(39)13-1)45-31-32-53-56(52-34-40-17-3-4-18-41(40)35-54(52)63-53)55(45)48-29-30-51(47-24-10-9-23-46(47)48)59-61-57(49-25-11-19-37-14-5-7-21-43(37)49)60-58(62-59)50-26-12-20-38-15-6-8-22-44(38)50;1-2-15-39(16-3-1)57-60-58(42-28-27-38-26-25-37-14-7-9-21-44(37)51(38)34-42)62-59(61-57)50-30-29-48(46-22-10-11-23-47(46)50)55-49(45-24-12-19-36-13-6-8-20-43(36)45)31-32-53-56(55)52-33-40-17-4-5-18-41(40)35-54(52)63-53;1-2-14-35(15-3-1)49-52-50(54-51(53-49)43-23-11-19-33-13-7-9-21-40(33)43)36-26-24-34(25-27-36)47-42(41-22-10-18-32-12-6-8-20-39(32)41)28-29-45-48(47)44-30-37-16-4-5-17-38(37)31-46(44)55-45/h2*1-35H;1-31H
InChIKeyDEYRISFZQVIZRJ-UHFFFAOYSA-N
XLogP45.31
TPSA155.43 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds15
Heavy Atoms181
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002305.73
LogP ≤ 545.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine?
The IUPAC name of 2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine (CID 164971653) is 2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine.
What is the SMILES notation for 2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine?
The canonical SMILES for 2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine is c1ccc(-c2nc(-c3ccc(-c4c(-c5cccc6ccccc56)ccc5oc6cc7ccccc7cc6c45)cc3)nc(-c3cccc4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccc4ccc5ccccc5c4c3)nc(-c3ccc(-c4c(-c5cccc6ccccc56)ccc5oc6cc7ccccc7cc6c45)c4ccccc34)n2)cc1.c1ccc2cc(-c3ccc4oc5cc6ccccc6cc5c4c3-c3ccc(-c4nc(-c5cccc6ccccc56)nc(-c5cccc6ccccc56)n4)c4ccccc34)ccc2c1.
What is the InChIKey of 2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine?
The InChIKey is DEYRISFZQVIZRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C59H35N3O.C51H31N3O/c1-2-16-39-33-42(28-27-36(39)13-1)45-31-32-53-56(52-34-40-17-3-4-18-41(40)35-54(52)63-53)55(45)48-29-30-51(47-24-10-9-23-46(47)48)59-61-57(49-25-11-19-37-14-5-7-21-43(37)49)60-58(62-59)50-26-12-20-38-15-6-8-22-44(38)50;1-2-15-39(16-3-1)57-60-58(42-28-27-38-26-25-37-14-7-9-21-44(37)51(38)34-42)62-59(61-57)50-30-29-48(46-22-10-11-23-47(46)50)55-49(45-24-12-19-36-13-6-8-20-43(36)45)31-32-53-56(55)52-33-40-17-4-5-18-41(40)35-54(52)63-53;1-2-14-35(15-3-1)49-52-50(54-51(53-49)43-23-11-19-33-13-7-9-21-40(33)43)36-26-24-34(25-27-36)47-42(41-22-10-18-32-12-6-8-20-39(32)41)28-29-45-48(47)44-30-37-16-4-5-17-38(37)31-46(44)55-45/h2*1-35H;1-31H.
What are the key properties of 2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine?
2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine has a molecular weight of 2305.73 g/mol, XLogP of 45.31, 15 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dinaphthalen-1-yl-6-[4-(2-naphthalen-2-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-1,3,5-triazine;2-naphthalen-1-yl-4-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-[4-(2-naphthalen-1-ylnaphtho[2,3-b][1]benzofuran-1-yl)naphthalen-1-yl]-4-phenanthren-3-yl-6-phenyl-1,3,5-triazine is sourced from PubChem (CID 164971653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).