2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine

C160H98N12O2S2 — CID 167671740

IUPAC2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5oc6c7ccccc7ccc6c45)n3)cc2)cc1.c1ccc(-c2nc(-c3ccc(-c4ccc5ccccc5c4)cc3)nc(-c3cccc4ccc5c6ccccc6oc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5ccc6c7ccccc7sc6c45)c4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5sc6c7ccccc7ccc6c45)c4ccccc34)n2)cc1
InChIInChI=1S/C41H25N3O.2C41H25N3S.C37H23N3O/c1-2-10-29(11-3-1)39-42-40(30-20-17-27(18-21-30)32-22-19-26-9-4-5-12-31(26)25-32)44-41(43-39)35-15-8-13-28-23-24-34-33-14-6-7-16-36(33)45-38(34)37(28)35;1-3-13-27(14-4-1)39-42-40(28-15-5-2-6-16-28)44-41(43-39)34-25-24-32(30-18-9-10-19-31(30)34)33-20-11-21-36-37(33)35-23-22-26-12-7-8-17-29(26)38(35)45-36;1-3-12-27(13-4-1)39-42-40(28-14-5-2-6-15-28)44-41(43-39)35-25-24-31(29-17-7-8-18-30(29)35)33-20-11-16-26-22-23-34-32-19-9-10-21-36(32)45-38(34)37(26)33;1-3-10-24(11-4-1)25-18-20-28(21-19-25)36-38-35(27-13-5-2-6-14-27)39-37(40-36)31-16-9-17-32-33(31)30-23-22-26-12-7-8-15-29(26)34(30)41-32/h3*1-25H;1-23H
InChIKeyUFGWJXKNOSAXQA-UHFFFAOYSA-N
MW2284.76 g/mol
LogP42.77
Rot. Bonds16

About 2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine

2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine (PubChem CID 167671740) has the molecular formula C160H98N12O2S2 and a molecular weight of 2284.76 g/mol. Its IUPAC name is 2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine
PubChem CID167671740
Molecular FormulaC160H98N12O2S2
Molecular Weight2284.76 g/mol
Exact Mass2282.74
IUPAC Name2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5oc6c7ccccc7ccc6c45)n3)cc2)cc1.c1ccc(-c2nc(-c3ccc(-c4ccc5ccccc5c4)cc3)nc(-c3cccc4ccc5c6ccccc6oc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5ccc6c7ccccc7sc6c45)c4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5sc6c7ccccc7ccc6c45)c4ccccc34)n2)cc1
InChIInChI=1S/C41H25N3O.2C41H25N3S.C37H23N3O/c1-2-10-29(11-3-1)39-42-40(30-20-17-27(18-21-30)32-22-19-26-9-4-5-12-31(26)25-32)44-41(43-39)35-15-8-13-28-23-24-34-33-14-6-7-16-36(33)45-38(34)37(28)35;1-3-13-27(14-4-1)39-42-40(28-15-5-2-6-16-28)44-41(43-39)34-25-24-32(30-18-9-10-19-31(30)34)33-20-11-21-36-37(33)35-23-22-26-12-7-8-17-29(26)38(35)45-36;1-3-12-27(13-4-1)39-42-40(28-14-5-2-6-15-28)44-41(43-39)35-25-24-31(29-17-7-8-18-30(29)35)33-20-11-16-26-22-23-34-32-19-9-10-21-36(32)45-38(34)37(26)33;1-3-10-24(11-4-1)25-18-20-28(21-19-25)36-38-35(27-13-5-2-6-14-27)39-37(40-36)31-16-9-17-32-33(31)30-23-22-26-12-7-8-15-29(26)34(30)41-32/h3*1-25H;1-23H
InChIKeyUFGWJXKNOSAXQA-UHFFFAOYSA-N
XLogP42.77
TPSA180.96 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds16
Heavy Atoms176
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002284.76
LogP ≤ 542.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine with MolForge

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Related Compounds

2-(3,5-diphenylphenyl)-4-naphtho[1,2-b][1]benzofuran-7-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzothiol-7-yl-6-phenyl-1,3,5-triazine;2-(4-naphthalen-2-ylphenyl)-4-phenyl-6-(12-thiapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-3-yl)-1,3,5-triazine
CID 167579224
2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine
CID 163736359
2-naphthalen-2-yl-4-(6-naphtho[1,2-b][1]benzothiol-5-yldibenzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 166743231
2-dibenzofuran-1-yl-4-naphtho[1,2-b][1]benzothiol-3-yl-6-phenyl-1,3,5-triazine;2-dibenzofuran-3-yl-4-naphtho[1,2-b][1]benzothiol-3-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzothiol-3-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
CID 167673267
2-dibenzofuran-4-yl-4-naphtho[1,2-b][1]benzothiol-4-yl-6-(4-phenylphenyl)-1,3,5-triazine
CID 163544939
2-(4-dibenzofuran-1-yldibenzofuran-1-yl)-4-dibenzothiophen-4-yl-6-naphthalen-2-yl-1,3,5-triazine
CID 166741703
2-dibenzofuran-3-yl-4-naphtho[1,2-b][1]benzothiol-7-yl-6-phenyl-1,3,5-triazine
CID 162504545
2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-2-yl-4,6-diphenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzothiol-1-yl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-naphtho[1,2-b][1]benzothiol-1-yl-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 160607641
2-(4-naphthalen-1-ylnaphthalen-1-yl)-4-naphtho[1,2-b][1]benzothiol-8-yl-6-(2-phenyldibenzofuran-4-yl)-1,3,5-triazine
CID 170305329
2-(6-naphthalen-2-yldibenzofuran-1-yl)-4-(2-naphtho[1,2-b][1]benzothiol-10-ylphenyl)-6-phenyl-1,3,5-triazine;2-(6-naphthalen-1-yldibenzofuran-1-yl)-4-naphtho[1,2-b][1]benzothiol-9-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzothiol-5-yl-4-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-1-yl]-1,3,5-triazine;2-(2-naphtho[1,2-b][1]benzothiol-10-ylphenyl)-4-phenyl-6-(6-phenyldibenzofuran-1-yl)-1,3,5-triazine
CID 163759628
2-dibenzothiophen-4-yl-4-(4-naphthalen-2-ylphenyl)-6-(3-phenyldibenzofuran-1-yl)-1,3,5-triazine
CID 170301891
2-(4-dibenzothiophen-4-ylphenyl)-4-(8-naphthalen-2-yldibenzofuran-1-yl)-6-phenyl-1,3,5-triazine
CID 139549050

Frequently Asked Questions

What is the IUPAC name of 2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine?
The IUPAC name of 2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine (CID 167671740) is 2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine.
What is the SMILES notation for 2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine?
The canonical SMILES for 2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine is c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5oc6c7ccccc7ccc6c45)n3)cc2)cc1.c1ccc(-c2nc(-c3ccc(-c4ccc5ccccc5c4)cc3)nc(-c3cccc4ccc5c6ccccc6oc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5ccc6c7ccccc7sc6c45)c4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5sc6c7ccccc7ccc6c45)c4ccccc34)n2)cc1.
What is the InChIKey of 2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine?
The InChIKey is UFGWJXKNOSAXQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H25N3O.2C41H25N3S.C37H23N3O/c1-2-10-29(11-3-1)39-42-40(30-20-17-27(18-21-30)32-22-19-26-9-4-5-12-31(26)25-32)44-41(43-39)35-15-8-13-28-23-24-34-33-14-6-7-16-36(33)45-38(34)37(28)35;1-3-13-27(14-4-1)39-42-40(28-15-5-2-6-16-28)44-41(43-39)34-25-24-32(30-18-9-10-19-31(30)34)33-20-11-21-36-37(33)35-23-22-26-12-7-8-17-29(26)38(35)45-36;1-3-12-27(13-4-1)39-42-40(28-14-5-2-6-15-28)44-41(43-39)35-25-24-31(29-17-7-8-18-30(29)35)33-20-11-16-26-22-23-34-32-19-9-10-21-36(32)45-38(34)37(26)33;1-3-10-24(11-4-1)25-18-20-28(21-19-25)36-38-35(27-13-5-2-6-14-27)39-37(40-36)31-16-9-17-32-33(31)30-23-22-26-12-7-8-15-29(26)34(30)41-32/h3*1-25H;1-23H.
What are the key properties of 2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine?
2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine has a molecular weight of 2284.76 g/mol, XLogP of 42.77, 16 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-naphthalen-2-ylphenyl)-4-naphtho[1,2-b][1]benzofuran-1-yl-6-phenyl-1,3,5-triazine;2-naphtho[1,2-b][1]benzofuran-7-yl-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-naphtho[1,2-b][1]benzothiol-7-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine is sourced from PubChem (CID 167671740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).