9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole

C168H108N6 — CID 158188539

IUPAC9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole
SMILESc1ccc(-c2c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3cc3c(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cccc23)cc1.c1ccc(-c2c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c3cc3c(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)cccc23)cc1.c1ccc(-c2c3cccc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)c3cc3c(-c4cccc5c6ccccc6n(-c6ccccc6)c45)cccc23)cc1
InChIInChI=1S/3C56H36N2/c1-4-18-37(19-5-1)54-44-28-14-26-40(46-30-16-32-48-42-24-10-12-34-52(42)57(55(46)48)38-20-6-2-7-21-38)50(44)36-51-41(27-15-29-45(51)54)47-31-17-33-49-43-25-11-13-35-53(43)58(56(47)49)39-22-8-3-9-23-39;1-4-16-37(17-5-1)56-48-26-14-24-42(38-30-32-46-44-22-10-12-28-52(44)57(54(46)34-38)40-18-6-2-7-19-40)50(48)36-51-43(25-15-27-49(51)56)39-31-33-47-45-23-11-13-29-53(45)58(55(47)35-39)41-20-8-3-9-21-41;1-4-16-37(17-5-1)56-46-26-14-24-42(38-30-32-54-50(34-38)44-22-10-12-28-52(44)57(54)40-18-6-2-7-19-40)48(46)36-49-43(25-15-27-47(49)56)39-31-33-55-51(35-39)45-23-11-13-29-53(45)58(55)41-20-8-3-9-21-41/h3*1-36H
InChIKeyFZLKNGVCIOEEBX-UHFFFAOYSA-N
MW2210.75 g/mol
LogP45.56
Rot. Bonds15

About 9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole

9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole (PubChem CID 158188539) has the molecular formula C168H108N6 and a molecular weight of 2210.75 g/mol. Its IUPAC name is 9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole.

Molecular Properties

Compound Name9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole
PubChem CID158188539
Molecular FormulaC168H108N6
Molecular Weight2210.75 g/mol
Exact Mass2208.86
IUPAC Name9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole
SMILESc1ccc(-c2c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3cc3c(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cccc23)cc1.c1ccc(-c2c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c3cc3c(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)cccc23)cc1.c1ccc(-c2c3cccc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)c3cc3c(-c4cccc5c6ccccc6n(-c6ccccc6)c45)cccc23)cc1
InChIInChI=1S/3C56H36N2/c1-4-18-37(19-5-1)54-44-28-14-26-40(46-30-16-32-48-42-24-10-12-34-52(42)57(55(46)48)38-20-6-2-7-21-38)50(44)36-51-41(27-15-29-45(51)54)47-31-17-33-49-43-25-11-13-35-53(43)58(56(47)49)39-22-8-3-9-23-39;1-4-16-37(17-5-1)56-48-26-14-24-42(38-30-32-46-44-22-10-12-28-52(44)57(54(46)34-38)40-18-6-2-7-19-40)50(48)36-51-43(25-15-27-49(51)56)39-31-33-47-45-23-11-13-29-53(45)58(55(47)35-39)41-20-8-3-9-21-41;1-4-16-37(17-5-1)56-46-26-14-24-42(38-30-32-54-50(34-38)44-22-10-12-28-52(44)57(54)40-18-6-2-7-19-40)48(46)36-49-43(25-15-27-47(49)56)39-31-33-55-51(35-39)45-23-11-13-29-53(45)58(55)41-20-8-3-9-21-41/h3*1-36H
InChIKeyFZLKNGVCIOEEBX-UHFFFAOYSA-N
XLogP45.56
TPSA29.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms174
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002210.75
LogP ≤ 545.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

1-[10-(4,5-dinaphthalen-1-ylanthracen-9-yl)-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]-9-phenylcarbazole;2-[10-(4,5-dinaphthalen-1-ylanthracen-9-yl)-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]-9-phenylcarbazole;3-[10-(4,5-dinaphthalen-1-ylanthracen-9-yl)-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]-9-phenylcarbazole
CID 160793440
9-phenyl-3-[8-(9-phenylcarbazol-3-yl)-10-(3-phenylphenyl)anthracen-1-yl]carbazole
CID 155333092
3-[10-(4,5-diphenylanthracen-9-yl)-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]-9-phenylcarbazole
CID 155333594
6-[4-[3-[4,5-bis(9-phenylcarbazol-1-yl)anthracen-9-yl]-9-phenylfluoren-9-yl]phenyl]-2-[10-(9,9-diphenylfluoren-3-yl)-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]-9-phenylcarbazole
CID 155335154
9-phenyl-2-[8-(9-phenylcarbazol-2-yl)-10-(6-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole
CID 155334848
9-phenyl-1-[8-(9-phenylcarbazol-1-yl)-10-(4-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole
CID 155333072
3-[9,10-dinaphthalen-1-yl-6-(9-phenylcarbazol-3-yl)anthracen-2-yl]-9-phenylcarbazole;2-naphthalen-1-yl-6,9,10-triphenylanthracene;2,9,10-trinaphthalen-1-yl-6-phenylanthracene
CID 160576501
5-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]-23-phenyl-23-azahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17,19,21-dodecaene
CID 147372966
1-[4,5-bis(9-phenylcarbazol-1-yl)anthracen-9-yl]-9-phenylcarbazole
CID 155335011
1-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;2-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;4-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 159875127
9-phenyl-3-[2-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]carbazole
CID 146414179
3-[10-anthracen-2-yl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]-9-phenylcarbazole
CID 155333639

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole?
The IUPAC name of 9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole (CID 158188539) is 9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole.
What is the SMILES notation for 9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole?
The canonical SMILES for 9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole is c1ccc(-c2c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3cc3c(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cccc23)cc1.c1ccc(-c2c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c3cc3c(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)cccc23)cc1.c1ccc(-c2c3cccc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)c3cc3c(-c4cccc5c6ccccc6n(-c6ccccc6)c45)cccc23)cc1.
What is the InChIKey of 9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole?
The InChIKey is FZLKNGVCIOEEBX-UHFFFAOYSA-N. The full InChI is InChI=1S/3C56H36N2/c1-4-18-37(19-5-1)54-44-28-14-26-40(46-30-16-32-48-42-24-10-12-34-52(42)57(55(46)48)38-20-6-2-7-21-38)50(44)36-51-41(27-15-29-45(51)54)47-31-17-33-49-43-25-11-13-35-53(43)58(56(47)49)39-22-8-3-9-23-39;1-4-16-37(17-5-1)56-48-26-14-24-42(38-30-32-46-44-22-10-12-28-52(44)57(54(46)34-38)40-18-6-2-7-19-40)50(48)36-51-43(25-15-27-49(51)56)39-31-33-47-45-23-11-13-29-53(45)58(55(47)35-39)41-20-8-3-9-21-41;1-4-16-37(17-5-1)56-46-26-14-24-42(38-30-32-54-50(34-38)44-22-10-12-28-52(44)57(54)40-18-6-2-7-19-40)48(46)36-49-43(25-15-27-47(49)56)39-31-33-55-51(35-39)45-23-11-13-29-53(45)58(55)41-20-8-3-9-21-41/h3*1-36H.
What are the key properties of 9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole?
9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole has a molecular weight of 2210.75 g/mol, XLogP of 45.56, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-1-[10-phenyl-8-(9-phenylcarbazol-1-yl)anthracen-1-yl]carbazole;9-phenyl-2-[10-phenyl-8-(9-phenylcarbazol-2-yl)anthracen-1-yl]carbazole;9-phenyl-3-[10-phenyl-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]carbazole is sourced from PubChem (CID 158188539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).