2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine

C168H117N3S — CID 159436810

IUPAC2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine
SMILESCC1(C)c2ccccc2-c2cc(-c3cc4c(cc3-c3cc(-c5ccccc5)cc(-c5ccccc5)n3)-c3ccccc3C4(c3ccccc3)c3ccccc3)ccc21.CC1(C)c2ccccc2-c2ccc(-c3cc4c(cc3-c3cc(-c5ccccc5)cc(-c5ccccc5)n3)-c3ccccc3C4(c3ccccc3)c3ccccc3)cc21.c1ccc(-c2cc(-c3ccccc3)nc(-c3cc4c(cc3-c3ccc5sc6ccccc6c5c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c2)cc1
InChIInChI=1S/2C57H41N.C54H35NS/c1-56(2)50-29-17-15-27-44(50)47-33-40(31-32-51(47)56)46-37-53-48(45-28-16-18-30-52(45)57(53,42-23-11-5-12-24-42)43-25-13-6-14-26-43)36-49(46)55-35-41(38-19-7-3-8-20-38)34-54(58-55)39-21-9-4-10-22-39;1-56(2)50-29-17-15-27-44(50)46-32-31-40(33-52(46)56)47-37-53-48(45-28-16-18-30-51(45)57(53,42-23-11-5-12-24-42)43-25-13-6-14-26-43)36-49(47)55-35-41(38-19-7-3-8-20-38)34-54(58-55)39-21-9-4-10-22-39;1-5-17-36(18-6-1)39-32-50(37-19-7-2-8-20-37)55-51(33-39)46-34-45-42-25-13-15-27-48(42)54(40-21-9-3-10-22-40,41-23-11-4-12-24-41)49(45)35-44(46)38-29-30-53-47(31-38)43-26-14-16-28-52(43)56-53/h2*3-37H,1-2H3;1-35H
InChIKeyLRRHVLRQFJWQNY-UHFFFAOYSA-N
MW2209.87 g/mol
LogP43.32
Rot. Bonds18

About 2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine

2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine (PubChem CID 159436810) has the molecular formula C168H117N3S and a molecular weight of 2209.87 g/mol. Its IUPAC name is 2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine.

Molecular Properties

Compound Name2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine
PubChem CID159436810
Molecular FormulaC168H117N3S
Molecular Weight2209.87 g/mol
Exact Mass2207.90
IUPAC Name2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine
SMILESCC1(C)c2ccccc2-c2cc(-c3cc4c(cc3-c3cc(-c5ccccc5)cc(-c5ccccc5)n3)-c3ccccc3C4(c3ccccc3)c3ccccc3)ccc21.CC1(C)c2ccccc2-c2ccc(-c3cc4c(cc3-c3cc(-c5ccccc5)cc(-c5ccccc5)n3)-c3ccccc3C4(c3ccccc3)c3ccccc3)cc21.c1ccc(-c2cc(-c3ccccc3)nc(-c3cc4c(cc3-c3ccc5sc6ccccc6c5c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c2)cc1
InChIInChI=1S/2C57H41N.C54H35NS/c1-56(2)50-29-17-15-27-44(50)47-33-40(31-32-51(47)56)46-37-53-48(45-28-16-18-30-52(45)57(53,42-23-11-5-12-24-42)43-25-13-6-14-26-43)36-49(46)55-35-41(38-19-7-3-8-20-38)34-54(58-55)39-21-9-4-10-22-39;1-56(2)50-29-17-15-27-44(50)46-32-31-40(33-52(46)56)47-37-53-48(45-28-16-18-30-51(45)57(53,42-23-11-5-12-24-42)43-25-13-6-14-26-43)36-49(47)55-35-41(38-19-7-3-8-20-38)34-54(58-55)39-21-9-4-10-22-39;1-5-17-36(18-6-1)39-32-50(37-19-7-2-8-20-37)55-51(33-39)46-34-45-42-25-13-15-27-48(42)54(40-21-9-3-10-22-40,41-23-11-4-12-24-41)49(45)35-44(46)38-29-30-53-47(31-38)43-26-14-16-28-52(43)56-53/h2*3-37H,1-2H3;1-35H
InChIKeyLRRHVLRQFJWQNY-UHFFFAOYSA-N
XLogP43.32
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds18
Heavy Atoms172
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002209.87
LogP ≤ 543.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine with MolForge

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Related Compounds

2-(2-dibenzofuran-3-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[3-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-2-yl]-4,6-diphenylpyrimidine;2-[3-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-2-yl]-4,6-diphenylpyrimidine
CID 159401101
4-(2-dibenzothiophen-2-ylphenyl)-6-[4-(9,9-diphenylfluoren-3-yl)phenyl]-2-phenylpyrimidine
CID 171602266
4-(4-dibenzothiophen-2-ylphenyl)-6-[2-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylpyrimidine
CID 171603115
2-(2-dibenzothiophen-4-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine
CID 137413902
4-dibenzothiophen-2-yl-6-[4-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-yl]-2-phenylpyrimidine
CID 168777088
4-(4-dibenzothiophen-3-ylphenyl)-2-(9,9-dimethylfluoren-2-yl)-6-(9,9-diphenylfluoren-2-yl)pyrimidine
CID 171602444
2-[1-(9,9-dimethylfluoren-3-yl)dibenzothiophen-3-yl]-4,6-diphenylpyrimidine;2-[1-(9,9-diphenylfluoren-3-yl)dibenzothiophen-3-yl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[1-(9,9'-spirobi[fluorene]-3-yl)dibenzothiophen-3-yl]-1,3,5-triazine
CID 163618386
4-[3-dibenzothiophen-2-yl-5-(3-phenylphenyl)phenyl]-6-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylpyrimidine
CID 171585075
4-dibenzothiophen-3-yl-2-[4-(9,9-dimethylfluoren-3-yl)naphthalen-1-yl]-6-(4-phenylphenyl)pyrimidine
CID 168777570
4-[3-dibenzothiophen-2-yl-5-(3-phenylphenyl)phenyl]-6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidine
CID 171582951
4-(3-dibenzothiophen-2-yl-5-naphthalen-1-ylphenyl)-6-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylpyrimidine
CID 171585529
4-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-2,6-diphenylpyrimidine;4-(2-dibenzothiophen-3-yl-9,9-diphenylfluoren-3-yl)-2,6-diphenylpyrimidine;3-[2-(2,6-diphenylpyrimidin-4-yl)-9,9-diphenylfluoren-3-yl]-9-phenylcarbazole
CID 160757853

Frequently Asked Questions

What is the IUPAC name of 2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine?
The IUPAC name of 2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine (CID 159436810) is 2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine.
What is the SMILES notation for 2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine?
The canonical SMILES for 2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine is CC1(C)c2ccccc2-c2cc(-c3cc4c(cc3-c3cc(-c5ccccc5)cc(-c5ccccc5)n3)-c3ccccc3C4(c3ccccc3)c3ccccc3)ccc21.CC1(C)c2ccccc2-c2ccc(-c3cc4c(cc3-c3cc(-c5ccccc5)cc(-c5ccccc5)n3)-c3ccccc3C4(c3ccccc3)c3ccccc3)cc21.c1ccc(-c2cc(-c3ccccc3)nc(-c3cc4c(cc3-c3ccc5sc6ccccc6c5c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c2)cc1.
What is the InChIKey of 2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine?
The InChIKey is LRRHVLRQFJWQNY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C57H41N.C54H35NS/c1-56(2)50-29-17-15-27-44(50)47-33-40(31-32-51(47)56)46-37-53-48(45-28-16-18-30-52(45)57(53,42-23-11-5-12-24-42)43-25-13-6-14-26-43)36-49(46)55-35-41(38-19-7-3-8-20-38)34-54(58-55)39-21-9-4-10-22-39;1-56(2)50-29-17-15-27-44(50)46-32-31-40(33-52(46)56)47-37-53-48(45-28-16-18-30-51(45)57(53,42-23-11-5-12-24-42)43-25-13-6-14-26-43)36-49(47)55-35-41(38-19-7-3-8-20-38)34-54(58-55)39-21-9-4-10-22-39;1-5-17-36(18-6-1)39-32-50(37-19-7-2-8-20-37)55-51(33-39)46-34-45-42-25-13-15-27-48(42)54(40-21-9-3-10-22-40,41-23-11-4-12-24-41)49(45)35-44(46)38-29-30-53-47(31-38)43-26-14-16-28-52(43)56-53/h2*3-37H,1-2H3;1-35H.
What are the key properties of 2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine?
2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine has a molecular weight of 2209.87 g/mol, XLogP of 43.32, 18 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-dibenzothiophen-2-yl-9,9-diphenylfluoren-3-yl)-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-2-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine;2-[2-(9,9-dimethylfluoren-3-yl)-9,9-diphenylfluoren-3-yl]-4,6-diphenylpyridine is sourced from PubChem (CID 159436810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).