2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine

C172H104N12S4 — CID 165036046

IUPAC2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3cc(-c4ccc5c(c4)sc4ccccc45)cc4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3cccc4cccc(-c5ccc6sc7ccccc7c6c5)c34)n2)cc1.c1ccc2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cc(-c5ccc6c(c5)sc5ccccc56)cc5ccccc45)n3)ccc2c1.c1ccc2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cccc5cccc(-c6ccc7sc8ccccc8c7c6)c45)n3)ccc2c1
InChIInChI=1S/2C45H27N3S.2C41H25N3S/c1-3-11-31-25-34(21-19-28(31)9-1)43-46-44(35-22-20-29-10-2-4-12-32(29)26-35)48-45(47-43)38-17-8-14-30-13-7-16-36(42(30)38)33-23-24-41-39(27-33)37-15-5-6-18-40(37)49-41;1-3-11-30-23-34(19-17-28(30)9-1)43-46-44(35-20-18-29-10-2-4-12-31(29)24-35)48-45(47-43)40-26-36(25-33-13-5-6-14-37(33)40)32-21-22-39-38-15-7-8-16-41(38)49-42(39)27-32;1-2-11-28(12-3-1)39-42-40(31-21-20-26-10-4-5-13-29(26)24-31)44-41(43-39)34-18-9-15-27-14-8-17-32(38(27)34)30-22-23-37-35(25-30)33-16-6-7-19-36(33)45-37;1-2-11-27(12-3-1)39-42-40(31-19-18-26-10-4-5-13-28(26)22-31)44-41(43-39)36-24-32(23-30-14-6-7-15-33(30)36)29-20-21-35-34-16-8-9-17-37(34)45-38(35)25-29/h2*1-27H;2*1-25H
InChIKeyNJWOBWXASVZDNU-UHFFFAOYSA-N
MW2467.08 g/mol
LogP47.16
Rot. Bonds16

About 2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine

2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine (PubChem CID 165036046) has the molecular formula C172H104N12S4 and a molecular weight of 2467.08 g/mol. Its IUPAC name is 2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine
PubChem CID165036046
Molecular FormulaC172H104N12S4
Molecular Weight2467.08 g/mol
Exact Mass2464.74
IUPAC Name2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3cc(-c4ccc5c(c4)sc4ccccc45)cc4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3cccc4cccc(-c5ccc6sc7ccccc7c6c5)c34)n2)cc1.c1ccc2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cc(-c5ccc6c(c5)sc5ccccc56)cc5ccccc45)n3)ccc2c1.c1ccc2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cccc5cccc(-c6ccc7sc8ccccc8c7c6)c45)n3)ccc2c1
InChIInChI=1S/2C45H27N3S.2C41H25N3S/c1-3-11-31-25-34(21-19-28(31)9-1)43-46-44(35-22-20-29-10-2-4-12-32(29)26-35)48-45(47-43)38-17-8-14-30-13-7-16-36(42(30)38)33-23-24-41-39(27-33)37-15-5-6-18-40(37)49-41;1-3-11-30-23-34(19-17-28(30)9-1)43-46-44(35-20-18-29-10-2-4-12-31(29)24-35)48-45(47-43)40-26-36(25-33-13-5-6-14-37(33)40)32-21-22-39-38-15-7-8-16-41(38)49-42(39)27-32;1-2-11-28(12-3-1)39-42-40(31-21-20-26-10-4-5-13-29(26)24-31)44-41(43-39)34-18-9-15-27-14-8-17-32(38(27)34)30-22-23-37-35(25-30)33-16-6-7-19-36(33)45-37;1-2-11-27(12-3-1)39-42-40(31-19-18-26-10-4-5-13-28(26)22-31)44-41(43-39)36-24-32(23-30-14-6-7-15-33(30)36)29-20-21-35-34-16-8-9-17-37(34)45-38(35)25-29/h2*1-27H;2*1-25H
InChIKeyNJWOBWXASVZDNU-UHFFFAOYSA-N
XLogP47.16
TPSA154.68 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds16
Heavy Atoms188
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002467.08
LogP ≤ 547.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine with MolForge

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Related Compounds

2-(4-dibenzothiophen-3-ylnaphthalen-2-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(4-dibenzothiophen-3-ylnaphthalen-2-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(5-dibenzothiophen-2-ylnaphthalen-2-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine
CID 165010752
2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine
CID 147229387
2-dibenzothiophen-3-yl-4-[3-(8-naphthalen-2-ylnaphthalen-2-yl)phenyl]-6-phenyl-1,3,5-triazine
CID 168845077
2-dibenzothiophen-3-yl-4-phenanthren-4-yl-6-[4-(8-phenylnaphthalen-1-yl)phenyl]-1,3,5-triazine
CID 169278876
2-(4-dibenzothiophen-3-ylphenyl)-4-(5-naphthalen-2-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine
CID 172509468
2-(9-dibenzothiophen-2-yldibenzofuran-1-yl)-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine
CID 167007911
2-[4-[8-(4-naphthalen-2-ylphenyl)dibenzothiophen-3-yl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine
CID 171596917
2-(2-dibenzothiophen-2-ylphenyl)-4-(4-naphthalen-2-ylphenyl)-6-phenyl-1,3,5-triazine
CID 172545497
2,4-dinaphthalen-1-yl-6-naphtho[2,1-b][1]benzothiol-2-yl-1,3,5-triazine;2,4-dinaphthalen-2-yl-6-naphtho[2,1-b][1]benzothiol-4-yl-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-naphtho[2,1-b][1]benzothiol-3-yl-1,3,5-triazine;2-naphthalen-1-yl-4-naphtho[2,1-b][1]benzothiol-1-yl-6-phenyl-1,3,5-triazine
CID 159219658
2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine
CID 163642676
2-dibenzothiophen-2-yl-4-(7-dibenzothiophen-3-yldibenzofuran-1-yl)-6-naphthalen-2-yl-1,3,5-triazine
CID 166743055
2-(4-naphthalen-2-ylphenyl)-4-phenyl-6-(7-phenyldibenzothiophen-1-yl)-1,3,5-triazine
CID 154934432

Frequently Asked Questions

What is the IUPAC name of 2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine?
The IUPAC name of 2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine (CID 165036046) is 2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine.
What is the SMILES notation for 2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine?
The canonical SMILES for 2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine is c1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3cc(-c4ccc5c(c4)sc4ccccc45)cc4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3cccc4cccc(-c5ccc6sc7ccccc7c6c5)c34)n2)cc1.c1ccc2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cc(-c5ccc6c(c5)sc5ccccc56)cc5ccccc45)n3)ccc2c1.c1ccc2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cccc5cccc(-c6ccc7sc8ccccc8c7c6)c45)n3)ccc2c1.
What is the InChIKey of 2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine?
The InChIKey is NJWOBWXASVZDNU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C45H27N3S.2C41H25N3S/c1-3-11-31-25-34(21-19-28(31)9-1)43-46-44(35-22-20-29-10-2-4-12-32(29)26-35)48-45(47-43)38-17-8-14-30-13-7-16-36(42(30)38)33-23-24-41-39(27-33)37-15-5-6-18-40(37)49-41;1-3-11-30-23-34(19-17-28(30)9-1)43-46-44(35-20-18-29-10-2-4-12-31(29)24-35)48-45(47-43)40-26-36(25-33-13-5-6-14-37(33)40)32-21-22-39-38-15-7-8-16-41(38)49-42(39)27-32;1-2-11-28(12-3-1)39-42-40(31-21-20-26-10-4-5-13-29(26)24-31)44-41(43-39)34-18-9-15-27-14-8-17-32(38(27)34)30-22-23-37-35(25-30)33-16-6-7-19-36(33)45-37;1-2-11-27(12-3-1)39-42-40(31-19-18-26-10-4-5-13-28(26)22-31)44-41(43-39)36-24-32(23-30-14-6-7-15-33(30)36)29-20-21-35-34-16-8-9-17-37(34)45-38(35)25-29/h2*1-27H;2*1-25H.
What are the key properties of 2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine?
2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine has a molecular weight of 2467.08 g/mol, XLogP of 47.16, 16 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(3-dibenzothiophen-3-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(8-dibenzothiophen-2-ylnaphthalen-1-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine is sourced from PubChem (CID 165036046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).