3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole

C71H45N5 — CID 162137186

IUPAC3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
SMILESc1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc(-c6cccc7c6-c6ccccc6C7)ccc54)c3)nc(-c3cccc(-n4c5ccccc5c5cc(-c6cccc7c6-c6ccccc6C7)ccc54)c3)n2)cc1
InChIInChI=1S/C71H45N5/c1-2-16-44(17-3-1)69-72-70(51-22-12-24-53(40-51)75-63-32-10-8-28-59(63)61-42-47(34-36-65(61)75)57-30-14-20-49-38-45-18-4-6-26-55(45)67(49)57)74-71(73-69)52-23-13-25-54(41-52)76-64-33-11-9-29-60(64)62-43-48(35-37-66(62)76)58-31-15-21-50-39-46-19-5-7-27-56(46)68(50)58/h1-37,40-43H,38-39H2
InChIKeyVEQWPXADUZZGOT-UHFFFAOYSA-N
MW968.18 g/mol
LogP17.54
Rot. Bonds7

About 3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole

3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole (PubChem CID 162137186) has the molecular formula C71H45N5 and a molecular weight of 968.18 g/mol. Its IUPAC name is 3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole.

Molecular Properties

Compound Name3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
PubChem CID162137186
Molecular FormulaC71H45N5
Molecular Weight968.18 g/mol
Exact Mass967.37
IUPAC Name3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
SMILESc1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc(-c6cccc7c6-c6ccccc6C7)ccc54)c3)nc(-c3cccc(-n4c5ccccc5c5cc(-c6cccc7c6-c6ccccc6C7)ccc54)c3)n2)cc1
InChIInChI=1S/C71H45N5/c1-2-16-44(17-3-1)69-72-70(51-22-12-24-53(40-51)75-63-32-10-8-28-59(63)61-42-47(34-36-65(61)75)57-30-14-20-49-38-45-18-4-6-26-55(45)67(49)57)74-71(73-69)52-23-13-25-54(41-52)76-64-33-11-9-29-60(64)62-43-48(35-37-66(62)76)58-31-15-21-50-39-46-19-5-7-27-56(46)68(50)58/h1-37,40-43H,38-39H2
InChIKeyVEQWPXADUZZGOT-UHFFFAOYSA-N
XLogP17.54
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms76
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500968.18
LogP ≤ 517.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole with MolForge

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Related Compounds

3-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-4-yl]-9-phenylcarbazole
CID 158375746
3-[3-[5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9H-fluoren-3-yl]phenyl]-9-phenylcarbazole
CID 154618882
3-(9H-fluoren-4-yl)-6-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 130230877
3-[5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-9H-fluoren-3-yl]-9-phenylcarbazole
CID 154618893
9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]carbazole
CID 58511626
3-(9H-fluoren-1-yl)-9-[3-[4-[3-methyl-2-(2-methylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
CID 145016968
3-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 158317836
3-(3-carbazol-9-ylphenyl)-6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-phenylcarbazole
CID 58943700
3-phenyl-9-[3-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]carbazole
CID 174243912
3-carbazol-9-yl-9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9H-fluoren-3-yl]carbazole
CID 159941537
3-[9-[4-(9H-fluoren-3-yl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-9-(3-phenylphenyl)carbazole
CID 169297724
3-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-(9-phenylcarbazol-3-yl)carbazole
CID 90211376

Frequently Asked Questions

What is the IUPAC name of 3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole?
The IUPAC name of 3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole (CID 162137186) is 3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole.
What is the SMILES notation for 3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole?
The canonical SMILES for 3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole is c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc(-c6cccc7c6-c6ccccc6C7)ccc54)c3)nc(-c3cccc(-n4c5ccccc5c5cc(-c6cccc7c6-c6ccccc6C7)ccc54)c3)n2)cc1.
What is the InChIKey of 3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole?
The InChIKey is VEQWPXADUZZGOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C71H45N5/c1-2-16-44(17-3-1)69-72-70(51-22-12-24-53(40-51)75-63-32-10-8-28-59(63)61-42-47(34-36-65(61)75)57-30-14-20-49-38-45-18-4-6-26-55(45)67(49)57)74-71(73-69)52-23-13-25-54(41-52)76-64-33-11-9-29-60(64)62-43-48(35-37-66(62)76)58-31-15-21-50-39-46-19-5-7-27-56(46)68(50)58/h1-37,40-43H,38-39H2.
What are the key properties of 3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole?
3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole has a molecular weight of 968.18 g/mol, XLogP of 17.54, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole is sourced from PubChem (CID 162137186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).