2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine

C170H107N11S3 — CID 167604173

IUPAC2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3nc(-c4ccc(-c5cccc6c5sc5ccccc56)cc4)nc(-c4cccc5c4-c4ccccc4C5(c4ccccc4)c4cccc5ccccc45)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5cccc6c5sc5ccccc56)cn4)nc(-c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)n3)cc2)cc1.c1ccc(-c2nc(-c3ccc(-c4cccc5c4sc4ccccc45)nc3)nc(-c3cccc4c3-c3ccccc3C4(c3ccccc3)c3ccccc3)n2)cc1
InChIInChI=1S/C62H39N3S.C57H36N4S.C51H32N4S/c1-3-16-40(17-4-1)41-32-36-44(37-33-41)59-63-60(45-38-34-43(35-39-45)48-25-14-26-50-49-23-10-12-31-56(49)66-58(48)50)65-61(64-59)52-27-15-30-55-57(52)51-24-9-11-28-54(51)62(55,46-20-5-2-6-21-46)53-29-13-19-42-18-7-8-22-47(42)53;1-4-16-37(17-5-1)38-30-32-39(33-31-38)54-59-55(61-56(60-54)50-35-34-40(36-58-50)43-24-14-25-45-44-22-11-13-29-51(44)62-53(43)45)47-26-15-28-49-52(47)46-23-10-12-27-48(46)57(49,41-18-6-2-7-19-41)42-20-8-3-9-21-42;1-4-16-33(17-5-1)48-53-49(34-30-31-44(52-32-34)40-25-14-24-38-37-22-11-13-29-45(37)56-47(38)40)55-50(54-48)41-26-15-28-43-46(41)39-23-10-12-27-42(39)51(43,35-18-6-2-7-19-35)36-20-8-3-9-21-36/h1-39H;1-36H;1-32H
InChIKeyKDRYIUIGXBXXFC-UHFFFAOYSA-N
MW2400.00 g/mol
LogP43.09
Rot. Bonds20

About 2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine

2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine (PubChem CID 167604173) has the molecular formula C170H107N11S3 and a molecular weight of 2400.00 g/mol. Its IUPAC name is 2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine
PubChem CID167604173
Molecular FormulaC170H107N11S3
Molecular Weight2400.00 g/mol
Exact Mass2397.79
IUPAC Name2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3nc(-c4ccc(-c5cccc6c5sc5ccccc56)cc4)nc(-c4cccc5c4-c4ccccc4C5(c4ccccc4)c4cccc5ccccc45)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5cccc6c5sc5ccccc56)cn4)nc(-c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)n3)cc2)cc1.c1ccc(-c2nc(-c3ccc(-c4cccc5c4sc4ccccc45)nc3)nc(-c3cccc4c3-c3ccccc3C4(c3ccccc3)c3ccccc3)n2)cc1
InChIInChI=1S/C62H39N3S.C57H36N4S.C51H32N4S/c1-3-16-40(17-4-1)41-32-36-44(37-33-41)59-63-60(45-38-34-43(35-39-45)48-25-14-26-50-49-23-10-12-31-56(49)66-58(48)50)65-61(64-59)52-27-15-30-55-57(52)51-24-9-11-28-54(51)62(55,46-20-5-2-6-21-46)53-29-13-19-42-18-7-8-22-47(42)53;1-4-16-37(17-5-1)38-30-32-39(33-31-38)54-59-55(61-56(60-54)50-35-34-40(36-58-50)43-24-14-25-45-44-22-11-13-29-51(44)62-53(43)45)47-26-15-28-49-52(47)46-23-10-12-27-48(46)57(49,41-18-6-2-7-19-41)42-20-8-3-9-21-42;1-4-16-33(17-5-1)48-53-49(34-30-31-44(52-32-34)40-25-14-24-38-37-22-11-13-29-45(37)56-47(38)40)55-50(54-48)41-26-15-28-43-46(41)39-23-10-12-27-42(39)51(43,35-18-6-2-7-19-35)36-20-8-3-9-21-36/h1-39H;1-36H;1-32H
InChIKeyKDRYIUIGXBXXFC-UHFFFAOYSA-N
XLogP43.09
TPSA141.79 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds20
Heavy Atoms184
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002400.00
LogP ≤ 543.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine with MolForge

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Related Compounds

2-(4-dibenzothiophen-4-ylphenyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-(4-dibenzothiophen-4-ylphenyl)-4-(9,9-diphenylfluoren-4-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-(4-dibenzothiophen-4-ylphenyl)-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazine
CID 167638600
2-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-4-(9,9-diphenylfluoren-4-yl)-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-4-(9,9-diphenylfluoren-1-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-4-(9,9-diphenylfluoren-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 167603616
4-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-6-(9,9-diphenylfluoren-4-yl)-2-phenylpyrimidine
CID 171603309
2-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine
CID 166024873
2-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-4-(4-naphthalen-1-ylphenyl)-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazine
CID 166024858
2-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-4-(2-phenylphenyl)-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazine
CID 166024922
2-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-4-(9,9-diphenylfluoren-4-yl)-6-(3-phenylphenyl)-1,3,5-triazine;2-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-4-(9,9-diphenylfluoren-1-yl)-6-phenyl-1,3,5-triazine;2-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-4-phenyl-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazine
CID 167570487
4-dibenzothiophen-4-yl-6-(9,9-diphenylfluoren-4-yl)-2-phenylpyrimidine
CID 171603284
2-dibenzothiophen-4-yl-4-[2-(4-phenylphenyl)phenyl]-6-(7,9,9-triphenylfluoren-4-yl)-1,3,5-triazine
CID 167349621
2-(3-dibenzothiophen-4-ylphenyl)-4-(9,9-diphenylfluoren-2-yl)-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-(3-dibenzothiophen-4-ylphenyl)-4-(9,9-diphenylfluoren-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-(3-dibenzothiophen-4-ylphenyl)-4-(9,9-diphenylfluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(3-dibenzothiophen-4-ylphenyl)-4-(2-phenylphenyl)-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazine;2-(3-dibenzothiophen-4-ylphenyl)-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-4'-yl)-1,3,5-triazine;2-(3-dibenzothiophen-4-ylphenyl)-4-phenyl-6-(9,9'-spirobi[fluorene]-3-yl)-1,3,5-triazine
CID 167624285
4-(4-dibenzothiophen-4-ylphenyl)-6-(9,9-diphenylfluoren-4-yl)-2-naphthalen-1-ylpyrimidine
CID 171603591
2-[4-[9-(4-dibenzothiophen-4-ylphenyl)fluoren-9-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 145377395

Frequently Asked Questions

What is the IUPAC name of 2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine?
The IUPAC name of 2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine (CID 167604173) is 2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine.
What is the SMILES notation for 2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine?
The canonical SMILES for 2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine is c1ccc(-c2ccc(-c3nc(-c4ccc(-c5cccc6c5sc5ccccc56)cc4)nc(-c4cccc5c4-c4ccccc4C5(c4ccccc4)c4cccc5ccccc45)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5cccc6c5sc5ccccc56)cn4)nc(-c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)n3)cc2)cc1.c1ccc(-c2nc(-c3ccc(-c4cccc5c4sc4ccccc45)nc3)nc(-c3cccc4c3-c3ccccc3C4(c3ccccc3)c3ccccc3)n2)cc1.
What is the InChIKey of 2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine?
The InChIKey is KDRYIUIGXBXXFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H39N3S.C57H36N4S.C51H32N4S/c1-3-16-40(17-4-1)41-32-36-44(37-33-41)59-63-60(45-38-34-43(35-39-45)48-25-14-26-50-49-23-10-12-31-56(49)66-58(48)50)65-61(64-59)52-27-15-30-55-57(52)51-24-9-11-28-54(51)62(55,46-20-5-2-6-21-46)53-29-13-19-42-18-7-8-22-47(42)53;1-4-16-37(17-5-1)38-30-32-39(33-31-38)54-59-55(61-56(60-54)50-35-34-40(36-58-50)43-24-14-25-45-44-22-11-13-29-51(44)62-53(43)45)47-26-15-28-49-52(47)46-23-10-12-27-48(46)57(49,41-18-6-2-7-19-41)42-20-8-3-9-21-42;1-4-16-33(17-5-1)48-53-49(34-30-31-44(52-32-34)40-25-14-24-38-37-22-11-13-29-45(37)56-47(38)40)55-50(54-48)41-26-15-28-43-46(41)39-23-10-12-27-42(39)51(43,35-18-6-2-7-19-35)36-20-8-3-9-21-36/h1-39H;1-36H;1-32H.
What are the key properties of 2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine?
2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine has a molecular weight of 2400.00 g/mol, XLogP of 43.09, 20 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-dibenzothiophen-4-ylphenyl)-4-(9-naphthalen-1-yl-9-phenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5-dibenzothiophen-4-yl-2-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yl-3-pyridinyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine is sourced from PubChem (CID 167604173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).