3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline

C141H90N8 — CID 159402578

IUPAC3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline
SMILESc1ccc(-c2cc(-c3ccc(-c4cc(-n5c6ccccc6c6ccccc65)cc(-n5c6ccccc6c6ccccc65)c4)cc3)nc3ccc4ccccc4c23)cc1.c1ccc(-c2cc(-c3ccc(-c4ccc(-c5ccc6ccc7cccnc7c6n5)cc4)cc3)nc3ccc4ccccc4c23)cc1.c1ccc(-c2cc(-c3ccc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)cc3)nc3ccc4ccccc4c23)cc1
InChIInChI=1S/C55H35N3.C43H27N3.C43H28N2/c1-2-14-37(15-3-1)48-35-50(56-49-31-30-38-16-4-5-17-43(38)55(48)49)39-28-26-36(27-29-39)40-32-41(57-51-22-10-6-18-44(51)45-19-7-11-23-52(45)57)34-42(33-40)58-53-24-12-8-20-46(53)47-21-9-13-25-54(47)58;1-2-7-30(8-3-1)37-27-40(45-39-25-22-31-9-4-5-11-36(31)41(37)39)33-18-14-29(15-19-33)28-12-16-32(17-13-28)38-24-23-35-21-20-34-10-6-26-44-42(34)43(35)46-38;1-2-11-30(12-3-1)38-28-40(44-39-26-25-31-13-4-5-16-35(31)43(38)39)32-23-21-29(22-24-32)33-14-10-15-34(27-33)45-41-19-8-6-17-36(41)37-18-7-9-20-42(37)45/h1-35H;1-27H;1-28H
InChIKeyLNNNLLMRCWCYPB-UHFFFAOYSA-N
MW1896.33 g/mol
LogP37.22
Rot. Bonds13

About 3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline

3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline (PubChem CID 159402578) has the molecular formula C141H90N8 and a molecular weight of 1896.33 g/mol. Its IUPAC name is 3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline.

Molecular Properties

Compound Name3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline
PubChem CID159402578
Molecular FormulaC141H90N8
Molecular Weight1896.33 g/mol
Exact Mass1894.73
IUPAC Name3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline
SMILESc1ccc(-c2cc(-c3ccc(-c4cc(-n5c6ccccc6c6ccccc65)cc(-n5c6ccccc6c6ccccc65)c4)cc3)nc3ccc4ccccc4c23)cc1.c1ccc(-c2cc(-c3ccc(-c4ccc(-c5ccc6ccc7cccnc7c6n5)cc4)cc3)nc3ccc4ccccc4c23)cc1.c1ccc(-c2cc(-c3ccc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)cc3)nc3ccc4ccccc4c23)cc1
InChIInChI=1S/C55H35N3.C43H27N3.C43H28N2/c1-2-14-37(15-3-1)48-35-50(56-49-31-30-38-16-4-5-17-43(38)55(48)49)39-28-26-36(27-29-39)40-32-41(57-51-22-10-6-18-44(51)45-19-7-11-23-52(45)57)34-42(33-40)58-53-24-12-8-20-46(53)47-21-9-13-25-54(47)58;1-2-7-30(8-3-1)37-27-40(45-39-25-22-31-9-4-5-11-36(31)41(37)39)33-18-14-29(15-19-33)28-12-16-32(17-13-28)38-24-23-35-21-20-34-10-6-26-44-42(34)43(35)46-38;1-2-11-30(12-3-1)38-28-40(44-39-26-25-31-13-4-5-16-35(31)43(38)39)32-23-21-29(22-24-32)33-14-10-15-34(27-33)45-41-19-8-6-17-36(41)37-18-7-9-20-42(37)45/h1-35H;1-27H;1-28H
InChIKeyLNNNLLMRCWCYPB-UHFFFAOYSA-N
XLogP37.22
TPSA79.24 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds13
Heavy Atoms149
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001896.33
LogP ≤ 537.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline with MolForge

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Related Compounds

1-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-3-phenylbenzo[f]quinoline;2-[4-[4-(3-phenylbenzo[f]quinolin-1-yl)phenyl]phenyl]-1,10-phenanthroline;5-[4-[4-(3-phenylbenzo[f]quinolin-1-yl)phenyl]phenyl]-1,10-phenanthroline;2-phenyl-9-[4-[4-(3-phenylbenzo[f]quinolin-1-yl)phenyl]phenyl]-1,10-phenanthroline
CID 158908007
2-[3-(1-phenylbenzo[f]quinolin-3-yl)phenyl]-1,10-phenanthroline;2-phenyl-9-[3-(1-phenylbenzo[f]quinolin-3-yl)phenyl]-1,10-phenanthroline;1-phenyl-3-[4-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]phenyl]benzo[f]quinoline
CID 161107449
3-[4-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]phenyl]-1-phenylbenzo[f]quinoline
CID 138643727
2-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]-1,10-phenanthroline
CID 138643771
1-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]-3-phenylbenzo[f]quinoline
CID 138643718
3-[3-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline
CID 138643729
3-(4-carbazol-9-ylphenyl)-1-phenylbenzo[f]quinoline
CID 138643776
3-phenyl-1-[3-(9-phenylcarbazol-3-yl)phenyl]benzo[f]quinoline
CID 138643715
7-[4-(3-carbazol-9-ylphenyl)phenyl]benzo[b][1,10]phenanthroline
CID 134559444
5-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]naphthalen-1-yl]-1,10-phenanthroline
CID 138644043
1-[4-[3-(4a,9a-dihydrocarbazol-9-yl)-5-carbazol-9-ylphenyl]phenyl]-3-phenylbenzo[f]quinoline
CID 166796406
7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole
CID 165109992

Frequently Asked Questions

What is the IUPAC name of 3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline?
The IUPAC name of 3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline (CID 159402578) is 3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline.
What is the SMILES notation for 3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline?
The canonical SMILES for 3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline is c1ccc(-c2cc(-c3ccc(-c4cc(-n5c6ccccc6c6ccccc65)cc(-n5c6ccccc6c6ccccc65)c4)cc3)nc3ccc4ccccc4c23)cc1.c1ccc(-c2cc(-c3ccc(-c4ccc(-c5ccc6ccc7cccnc7c6n5)cc4)cc3)nc3ccc4ccccc4c23)cc1.c1ccc(-c2cc(-c3ccc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)cc3)nc3ccc4ccccc4c23)cc1.
What is the InChIKey of 3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline?
The InChIKey is LNNNLLMRCWCYPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H35N3.C43H27N3.C43H28N2/c1-2-14-37(15-3-1)48-35-50(56-49-31-30-38-16-4-5-17-43(38)55(48)49)39-28-26-36(27-29-39)40-32-41(57-51-22-10-6-18-44(51)45-19-7-11-23-52(45)57)34-42(33-40)58-53-24-12-8-20-46(53)47-21-9-13-25-54(47)58;1-2-7-30(8-3-1)37-27-40(45-39-25-22-31-9-4-5-11-36(31)41(37)39)33-18-14-29(15-19-33)28-12-16-32(17-13-28)38-24-23-35-21-20-34-10-6-26-44-42(34)43(35)46-38;1-2-11-30(12-3-1)38-28-40(44-39-26-25-31-13-4-5-16-35(31)43(38)39)32-23-21-29(22-24-32)33-14-10-15-34(27-33)45-41-19-8-6-17-36(41)37-18-7-9-20-42(37)45/h1-35H;1-27H;1-28H.
What are the key properties of 3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline?
3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline has a molecular weight of 1896.33 g/mol, XLogP of 37.22, 13 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(3-carbazol-9-ylphenyl)phenyl]-1-phenylbenzo[f]quinoline;3-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-1-phenylbenzo[f]quinoline;2-[4-[4-(1-phenylbenzo[f]quinolin-3-yl)phenyl]phenyl]-1,10-phenanthroline is sourced from PubChem (CID 159402578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).