2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine

C147H89N9O3S — CID 163618006

IUPAC2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3c4ccccc4c(-c4nc(-c5ccccc5)nc(-c5ccc6ccccc6c5)n4)c4c3oc3ccccc34)cc2)cc1.c1ccc(-c2ccc3cc(-c4c5ccccc5c(-c5nc(-c6ccccc6)nc(-c6ccc7ccccc7c6)n5)c5c4oc4ccccc45)ccc3c2)cc1.c1ccc(-c2nc(-c3ccc(-c4c5ccccc5c(-c5ccccc5)c5sc6ccccc6c45)cc3)nc(-c3ccc4c(c3)oc3ccccc34)n2)cc1
InChIInChI=1S/C51H31N3O.C49H29N3OS.C47H29N3O/c1-3-13-32(14-4-1)36-24-25-38-30-39(27-26-37(38)29-36)45-41-19-9-10-20-42(41)47(46-43-21-11-12-22-44(43)55-48(45)46)51-53-49(34-16-5-2-6-17-34)52-50(54-51)40-28-23-33-15-7-8-18-35(33)31-40;1-3-13-30(14-4-1)44-38-19-8-7-18-37(38)43(45-39-20-10-12-22-42(39)54-46(44)45)31-23-25-33(26-24-31)48-50-47(32-15-5-2-6-16-32)51-49(52-48)34-27-28-36-35-17-9-11-21-40(35)53-41(36)29-34;1-3-13-30(14-4-1)32-23-26-33(27-24-32)41-37-19-9-10-20-38(37)43(42-39-21-11-12-22-40(39)51-44(41)42)47-49-45(34-16-5-2-6-17-34)48-46(50-47)36-28-25-31-15-7-8-18-35(31)29-36/h1-31H;1-29H;1-29H
InChIKeyHLQABHYCNDURJD-UHFFFAOYSA-N
MW2061.46 g/mol
LogP39.61
Rot. Bonds15

About 2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine

2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine (PubChem CID 163618006) has the molecular formula C147H89N9O3S and a molecular weight of 2061.46 g/mol. Its IUPAC name is 2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine.

Molecular Properties

Compound Name2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine
PubChem CID163618006
Molecular FormulaC147H89N9O3S
Molecular Weight2061.46 g/mol
Exact Mass2059.68
IUPAC Name2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3c4ccccc4c(-c4nc(-c5ccccc5)nc(-c5ccc6ccccc6c5)n4)c4c3oc3ccccc34)cc2)cc1.c1ccc(-c2ccc3cc(-c4c5ccccc5c(-c5nc(-c6ccccc6)nc(-c6ccc7ccccc7c6)n5)c5c4oc4ccccc45)ccc3c2)cc1.c1ccc(-c2nc(-c3ccc(-c4c5ccccc5c(-c5ccccc5)c5sc6ccccc6c45)cc3)nc(-c3ccc4c(c3)oc3ccccc34)n2)cc1
InChIInChI=1S/C51H31N3O.C49H29N3OS.C47H29N3O/c1-3-13-32(14-4-1)36-24-25-38-30-39(27-26-37(38)29-36)45-41-19-9-10-20-42(41)47(46-43-21-11-12-22-44(43)55-48(45)46)51-53-49(34-16-5-2-6-17-34)52-50(54-51)40-28-23-33-15-7-8-18-35(33)31-40;1-3-13-30(14-4-1)44-38-19-8-7-18-37(38)43(45-39-20-10-12-22-42(39)54-46(44)45)31-23-25-33(26-24-31)48-50-47(32-15-5-2-6-16-32)51-49(52-48)34-27-28-36-35-17-9-11-21-40(35)53-41(36)29-34;1-3-13-30(14-4-1)32-23-26-33(27-24-32)41-37-19-9-10-20-38(37)43(42-39-21-11-12-22-40(39)51-44(41)42)47-49-45(34-16-5-2-6-17-34)48-46(50-47)36-28-25-31-15-7-8-18-35(31)29-36/h1-31H;1-29H;1-29H
InChIKeyHLQABHYCNDURJD-UHFFFAOYSA-N
XLogP39.61
TPSA155.43 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds15
Heavy Atoms160
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002061.46
LogP ≤ 539.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Analyze 2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine?
The IUPAC name of 2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine (CID 163618006) is 2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine.
What is the SMILES notation for 2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine?
The canonical SMILES for 2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine is c1ccc(-c2ccc(-c3c4ccccc4c(-c4nc(-c5ccccc5)nc(-c5ccc6ccccc6c5)n4)c4c3oc3ccccc34)cc2)cc1.c1ccc(-c2ccc3cc(-c4c5ccccc5c(-c5nc(-c6ccccc6)nc(-c6ccc7ccccc7c6)n5)c5c4oc4ccccc45)ccc3c2)cc1.c1ccc(-c2nc(-c3ccc(-c4c5ccccc5c(-c5ccccc5)c5sc6ccccc6c45)cc3)nc(-c3ccc4c(c3)oc3ccccc34)n2)cc1.
What is the InChIKey of 2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine?
The InChIKey is HLQABHYCNDURJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H31N3O.C49H29N3OS.C47H29N3O/c1-3-13-32(14-4-1)36-24-25-38-30-39(27-26-37(38)29-36)45-41-19-9-10-20-42(41)47(46-43-21-11-12-22-44(43)55-48(45)46)51-53-49(34-16-5-2-6-17-34)52-50(54-51)40-28-23-33-15-7-8-18-35(33)31-40;1-3-13-30(14-4-1)44-38-19-8-7-18-37(38)43(45-39-20-10-12-22-42(39)54-46(44)45)31-23-25-33(26-24-31)48-50-47(32-15-5-2-6-16-32)51-49(52-48)34-27-28-36-35-17-9-11-21-40(35)53-41(36)29-34;1-3-13-30(14-4-1)32-23-26-33(27-24-32)41-37-19-9-10-20-38(37)43(42-39-21-11-12-22-40(39)51-44(41)42)47-49-45(34-16-5-2-6-17-34)48-46(50-47)36-28-25-31-15-7-8-18-35(31)29-36/h1-31H;1-29H;1-29H.
What are the key properties of 2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine?
2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine has a molecular weight of 2061.46 g/mol, XLogP of 39.61, 15 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-3-yl-4-phenyl-6-[4-(6-phenylnaphtho[3,2-b][1]benzothiol-11-yl)phenyl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(6-phenylnaphthalen-2-yl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[6-(4-phenylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]-1,3,5-triazine is sourced from PubChem (CID 163618006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).