2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine

C156H98N12Se4 — CID 167575606

IUPAC2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc5[se]c6c(-c7ccc8ccccc8c7)cccc6c5c4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5[se]c6c(-c7ccc8ccccc8c7)cccc6c45)n3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3[se]c3c(-c5cc(-c6ccccc6)c6ccccc6c5)cccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3[se]c3ccccc34)n2)cc1
InChIInChI=1S/3C43H27N3Se.C27H17N3Se/c1-4-14-28(15-5-1)38-27-32(26-31-20-10-11-21-33(31)38)34-22-12-23-35-36-24-13-25-37(40(36)47-39(34)35)43-45-41(29-16-6-2-7-17-29)44-42(46-43)30-18-8-3-9-19-30;1-3-11-28(12-4-1)30-21-24-32(25-22-30)42-44-41(31-14-5-2-6-15-31)45-43(46-42)37-19-10-20-38-39(37)36-18-9-17-35(40(36)47-38)34-26-23-29-13-7-8-16-33(29)27-34;1-3-10-28(11-4-1)30-18-21-32(22-19-30)42-44-41(31-13-5-2-6-14-31)45-43(46-42)35-24-25-39-38(27-35)37-17-9-16-36(40(37)47-39)34-23-20-29-12-7-8-15-33(29)26-34;1-3-10-18(11-4-1)25-28-26(19-12-5-2-6-13-19)30-27(29-25)22-16-9-15-21-20-14-7-8-17-23(20)31-24(21)22/h3*1-27H;1-17H
InChIKeyGMIAEWZZJJARCN-UHFFFAOYSA-N
MW2456.42 g/mol
LogP38.41
Rot. Bonds18

About 2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine

2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine (PubChem CID 167575606) has the molecular formula C156H98N12Se4 and a molecular weight of 2456.42 g/mol. Its IUPAC name is 2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
PubChem CID167575606
Molecular FormulaC156H98N12Se4
Molecular Weight2456.42 g/mol
Exact Mass2458.47
IUPAC Name2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc5[se]c6c(-c7ccc8ccccc8c7)cccc6c5c4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5[se]c6c(-c7ccc8ccccc8c7)cccc6c45)n3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3[se]c3c(-c5cc(-c6ccccc6)c6ccccc6c5)cccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3[se]c3ccccc34)n2)cc1
InChIInChI=1S/3C43H27N3Se.C27H17N3Se/c1-4-14-28(15-5-1)38-27-32(26-31-20-10-11-21-33(31)38)34-22-12-23-35-36-24-13-25-37(40(36)47-39(34)35)43-45-41(29-16-6-2-7-17-29)44-42(46-43)30-18-8-3-9-19-30;1-3-11-28(12-4-1)30-21-24-32(25-22-30)42-44-41(31-14-5-2-6-15-31)45-43(46-42)37-19-10-20-38-39(37)36-18-9-17-35(40(36)47-38)34-26-23-29-13-7-8-16-33(29)27-34;1-3-10-28(11-4-1)30-18-21-32(22-19-30)42-44-41(31-13-5-2-6-14-31)45-43(46-42)35-24-25-39-38(27-35)37-17-9-16-36(40(37)47-39)34-23-20-29-12-7-8-15-33(29)26-34;1-3-10-18(11-4-1)25-28-26(19-12-5-2-6-13-19)30-27(29-25)22-16-9-15-21-20-14-7-8-17-23(20)31-24(21)22/h3*1-27H;1-17H
InChIKeyGMIAEWZZJJARCN-UHFFFAOYSA-N
XLogP38.41
TPSA154.68 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds18
Heavy Atoms172
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002456.42
LogP ≤ 538.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze 2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine?
The IUPAC name of 2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine (CID 167575606) is 2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine.
What is the SMILES notation for 2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine?
The canonical SMILES for 2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine is c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc5[se]c6c(-c7ccc8ccccc8c7)cccc6c5c4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5[se]c6c(-c7ccc8ccccc8c7)cccc6c45)n3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3[se]c3c(-c5cc(-c6ccccc6)c6ccccc6c5)cccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3[se]c3ccccc34)n2)cc1.
What is the InChIKey of 2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine?
The InChIKey is GMIAEWZZJJARCN-UHFFFAOYSA-N. The full InChI is InChI=1S/3C43H27N3Se.C27H17N3Se/c1-4-14-28(15-5-1)38-27-32(26-31-20-10-11-21-33(31)38)34-22-12-23-35-36-24-13-25-37(40(36)47-39(34)35)43-45-41(29-16-6-2-7-17-29)44-42(46-43)30-18-8-3-9-19-30;1-3-11-28(12-4-1)30-21-24-32(25-22-30)42-44-41(31-14-5-2-6-15-31)45-43(46-42)37-19-10-20-38-39(37)36-18-9-17-35(40(36)47-38)34-26-23-29-13-7-8-16-33(29)27-34;1-3-10-28(11-4-1)30-18-21-32(22-19-30)42-44-41(31-13-5-2-6-14-31)45-43(46-42)35-24-25-39-38(27-35)37-17-9-16-36(40(37)47-39)34-23-20-29-12-7-8-15-33(29)26-34;1-3-10-18(11-4-1)25-28-26(19-12-5-2-6-13-19)30-27(29-25)22-16-9-15-21-20-14-7-8-17-23(20)31-24(21)22/h3*1-27H;1-17H.
What are the key properties of 2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine?
2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine has a molecular weight of 2456.42 g/mol, XLogP of 38.41, 18 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzoselenophen-4-yl-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[6-(4-phenylnaphthalen-2-yl)dibenzoselenophen-4-yl]-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-naphthalen-2-yldibenzoselenophen-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine is sourced from PubChem (CID 167575606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).