2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine

C153H95N9S3 — CID 159934634

IUPAC2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3ccc4ccc(-c5nc(-c6cccc(-c7ccccc7)c6)nc(-c6cccc7c6sc6ccccc67)n5)cc4c3)cc2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccc5ccc(-c6c7ccccc7c(-c7ccccc7)c7ccccc67)cc5c4)nc(-c4cccc5c4sc4ccccc45)n3)c2)cc1.c1ccc(-c2ccccc2-c2nc(-c3ccc4cc(-c5ccc6ccccc6c5)ccc4c3)nc(-c3cccc4c3sc3ccccc34)n2)cc1
InChIInChI=1S/C57H35N3S.C49H31N3S.C47H29N3S/c1-3-15-36(16-4-1)39-19-13-20-41(33-39)55-58-56(60-57(59-55)50-27-14-26-49-44-21-11-12-28-51(44)61-54(49)50)42-32-30-37-29-31-40(34-43(37)35-42)53-47-24-9-7-22-45(47)52(38-17-5-2-6-18-38)46-23-8-10-25-48(46)53;1-3-11-32(12-4-1)34-21-23-35(24-22-34)38-27-25-36-26-28-40(31-41(36)30-38)48-50-47(39-16-9-15-37(29-39)33-13-5-2-6-14-33)51-49(52-48)44-19-10-18-43-42-17-7-8-20-45(42)53-46(43)44;1-2-12-31(13-3-1)38-15-6-7-17-41(38)46-48-45(49-47(50-46)42-19-10-18-40-39-16-8-9-20-43(39)51-44(40)42)37-26-25-35-28-34(23-24-36(35)29-37)33-22-21-30-11-4-5-14-32(30)27-33/h1-35H;1-31H;1-29H
InChIKeyOABULYQRKBQFFS-UHFFFAOYSA-N
MW2155.71 g/mol
LogP41.98
Rot. Bonds17

About 2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine

2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine (PubChem CID 159934634) has the molecular formula C153H95N9S3 and a molecular weight of 2155.71 g/mol. Its IUPAC name is 2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine.

Molecular Properties

Compound Name2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine
PubChem CID159934634
Molecular FormulaC153H95N9S3
Molecular Weight2155.71 g/mol
Exact Mass2153.69
IUPAC Name2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3ccc4ccc(-c5nc(-c6cccc(-c7ccccc7)c6)nc(-c6cccc7c6sc6ccccc67)n5)cc4c3)cc2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccc5ccc(-c6c7ccccc7c(-c7ccccc7)c7ccccc67)cc5c4)nc(-c4cccc5c4sc4ccccc45)n3)c2)cc1.c1ccc(-c2ccccc2-c2nc(-c3ccc4cc(-c5ccc6ccccc6c5)ccc4c3)nc(-c3cccc4c3sc3ccccc34)n2)cc1
InChIInChI=1S/C57H35N3S.C49H31N3S.C47H29N3S/c1-3-15-36(16-4-1)39-19-13-20-41(33-39)55-58-56(60-57(59-55)50-27-14-26-49-44-21-11-12-28-51(44)61-54(49)50)42-32-30-37-29-31-40(34-43(37)35-42)53-47-24-9-7-22-45(47)52(38-17-5-2-6-18-38)46-23-8-10-25-48(46)53;1-3-11-32(12-4-1)34-21-23-35(24-22-34)38-27-25-36-26-28-40(31-41(36)30-38)48-50-47(39-16-9-15-37(29-39)33-13-5-2-6-14-33)51-49(52-48)44-19-10-18-43-42-17-7-8-20-45(42)53-46(43)44;1-2-12-31(13-3-1)38-15-6-7-17-41(38)46-48-45(49-47(50-46)42-19-10-18-40-39-16-8-9-20-43(39)51-44(40)42)37-26-25-35-28-34(23-24-36(35)29-37)33-22-21-30-11-4-5-14-32(30)27-33/h1-35H;1-31H;1-29H
InChIKeyOABULYQRKBQFFS-UHFFFAOYSA-N
XLogP41.98
TPSA116.01 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds17
Heavy Atoms165
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002155.71
LogP ≤ 541.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine with MolForge

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Related Compounds

2-dibenzothiophen-4-yl-4-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(2-phenylphenyl)-1,3,5-triazine
CID 139442140
2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(7-phenylnaphthalen-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 161003212
2-dibenzothiophen-4-yl-4-naphthalen-2-yl-6-(3-phenylphenyl)-1,3,5-triazine
CID 177119517
2-dibenzothiophen-4-yl-4-(3-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 139441895
2-dibenzothiophen-4-yl-4-(3-naphthalen-2-ylphenyl)-6-(4-naphthalen-2-ylphenyl)-1,3,5-triazine
CID 139441907
2-dibenzothiophen-4-yl-4-(4-naphthalen-2-ylphenyl)-6-[4-(7-phenylnaphthalen-2-yl)phenyl]-1,3,5-triazine
CID 139441659
2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[6-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine
CID 139442031
2-dibenzothiophen-4-yl-4-(3-naphthalen-2-ylphenyl)-6-(4-phenylnaphthalen-1-yl)-1,3,5-triazine
CID 139442167
2-dibenzothiophen-4-yl-4-phenyl-6-[3-[3-(10-phenylanthracen-9-yl)phenyl]phenyl]-1,3,5-triazine
CID 139442256
2-(3-dibenzothiophen-4-yl-5-naphthalen-2-ylphenyl)-4,6-bis(2-phenylphenyl)-1,3,5-triazine
CID 164942411
2-dibenzothiophen-4-yl-4-naphthalen-1-yl-6-[3-[3-(10-phenylanthracen-9-yl)phenyl]phenyl]-1,3,5-triazine
CID 139442371
2-dibenzothiophen-4-yl-4-naphthalen-1-yl-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine
CID 139442042

Frequently Asked Questions

What is the IUPAC name of 2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine?
The IUPAC name of 2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine (CID 159934634) is 2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine.
What is the SMILES notation for 2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine?
The canonical SMILES for 2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine is c1ccc(-c2ccc(-c3ccc4ccc(-c5nc(-c6cccc(-c7ccccc7)c6)nc(-c6cccc7c6sc6ccccc67)n5)cc4c3)cc2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccc5ccc(-c6c7ccccc7c(-c7ccccc7)c7ccccc67)cc5c4)nc(-c4cccc5c4sc4ccccc45)n3)c2)cc1.c1ccc(-c2ccccc2-c2nc(-c3ccc4cc(-c5ccc6ccccc6c5)ccc4c3)nc(-c3cccc4c3sc3ccccc34)n2)cc1.
What is the InChIKey of 2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine?
The InChIKey is OABULYQRKBQFFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H35N3S.C49H31N3S.C47H29N3S/c1-3-15-36(16-4-1)39-19-13-20-41(33-39)55-58-56(60-57(59-55)50-27-14-26-49-44-21-11-12-28-51(44)61-54(49)50)42-32-30-37-29-31-40(34-43(37)35-42)53-47-24-9-7-22-45(47)52(38-17-5-2-6-18-38)46-23-8-10-25-48(46)53;1-3-11-32(12-4-1)34-21-23-35(24-22-34)38-27-25-36-26-28-40(31-41(36)30-38)48-50-47(39-16-9-15-37(29-39)33-13-5-2-6-14-33)51-49(52-48)44-19-10-18-43-42-17-7-8-20-45(42)53-46(43)44;1-2-12-31(13-3-1)38-15-6-7-17-41(38)46-48-45(49-47(50-46)42-19-10-18-40-39-16-8-9-20-43(39)51-44(40)42)37-26-25-35-28-34(23-24-36(35)29-37)33-22-21-30-11-4-5-14-32(30)27-33/h1-35H;1-31H;1-29H.
What are the key properties of 2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine?
2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine has a molecular weight of 2155.71 g/mol, XLogP of 41.98, 17 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzothiophen-4-yl-4-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzothiophen-4-yl-4-(3-phenylphenyl)-6-[7-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine is sourced from PubChem (CID 159934634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).