9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole

C137H90N4 — CID 157185828

IUPAC9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole
SMILESCCn1c2ccccc2c2cc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccccc34)ccc21.c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)c3cc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)ccc3n4-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)c3ccccc3n4-c3cnc4ccccc4c3)c3ccccc23)cc1
InChIInChI=1S/C58H37N.C41H26N2.C38H27N/c1-4-18-38(19-5-1)55-43-24-10-14-28-47(43)57(48-29-15-11-25-44(48)55)40-32-34-53-51(36-40)52-37-41(33-35-54(52)59(53)42-22-8-3-9-23-42)58-49-30-16-12-26-45(49)56(39-20-6-2-7-21-39)46-27-13-17-31-50(46)58;1-2-12-27(13-3-1)40-32-16-5-7-18-34(32)41(35-19-8-6-17-33(35)40)29-22-23-39-36(25-29)31-15-9-11-21-38(31)43(39)30-24-28-14-4-10-20-37(28)42-26-30;1-2-39-35-21-10-9-15-28(35)34-24-26(22-23-36(34)39)37-30-16-5-7-18-32(30)38(33-19-8-6-17-31(33)37)29-20-11-13-25-12-3-4-14-27(25)29/h1-37H;1-26H;3-24H,2H2,1H3
InChIKeyAPCKQIAYZRORJT-UHFFFAOYSA-N
MW1792.26 g/mol
LogP37.64
Rot. Bonds11

About 9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole

9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole (PubChem CID 157185828) has the molecular formula C137H90N4 and a molecular weight of 1792.26 g/mol. Its IUPAC name is 9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole.

Molecular Properties

Compound Name9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole
PubChem CID157185828
Molecular FormulaC137H90N4
Molecular Weight1792.26 g/mol
Exact Mass1790.72
IUPAC Name9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole
SMILESCCn1c2ccccc2c2cc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccccc34)ccc21.c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)c3cc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)ccc3n4-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)c3ccccc3n4-c3cnc4ccccc4c3)c3ccccc23)cc1
InChIInChI=1S/C58H37N.C41H26N2.C38H27N/c1-4-18-38(19-5-1)55-43-24-10-14-28-47(43)57(48-29-15-11-25-44(48)55)40-32-34-53-51(36-40)52-37-41(33-35-54(52)59(53)42-22-8-3-9-23-42)58-49-30-16-12-26-45(49)56(39-20-6-2-7-21-39)46-27-13-17-31-50(46)58;1-2-12-27(13-3-1)40-32-16-5-7-18-34(32)41(35-19-8-6-17-33(35)40)29-22-23-39-36(25-29)31-15-9-11-21-38(31)43(39)30-24-28-14-4-10-20-37(28)42-26-30;1-2-39-35-21-10-9-15-28(35)34-24-26(22-23-36(34)39)37-30-16-5-7-18-32(30)38(33-19-8-6-17-31(33)37)29-20-11-13-25-12-3-4-14-27(25)29/h1-37H;1-26H;3-24H,2H2,1H3
InChIKeyAPCKQIAYZRORJT-UHFFFAOYSA-N
XLogP37.64
TPSA27.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms141
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001792.26
LogP ≤ 537.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

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
4-(4-naphthalen-1-ylphenyl)-N-[4-(10-phenylanthracen-9-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 59282036
N-(4-naphthalen-1-ylphenyl)-N-[4-(10-phenylanthracen-9-yl)phenyl]-4-(9-phenylcarbazol-3-yl)aniline;N-[4-(10-phenylanthracen-9-yl)phenyl]-4-(9-phenylcarbazol-3-yl)-N-[4-(2-phenylphenyl)phenyl]aniline;N-[4-(10-phenylanthracen-9-yl)phenyl]-4-(9-phenylcarbazol-3-yl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 160771510
9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole
CID 58273441
9-naphthalen-2-yl-3-(10-pyridin-3-ylanthracen-9-yl)carbazole;3-(10-pyridin-3-ylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-pyridin-3-yl-3-(10-pyridin-3-ylanthracen-9-yl)carbazole
CID 159111759
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
9-quinolin-3-ylcarbazole
CID 138984974
3-[10-(4a,8a-dihydronaphthalen-1-yl)anthracen-9-yl]-6-(10-naphthalen-1-ylanthracen-9-yl)-9-phenylcarbazole;9-ethyl-3-(10-naphthalen-2-ylanthracen-9-yl)carbazole;3-(10-naphthalen-2-ylanthracen-9-yl)-9-phenylcarbazole
CID 159189718
9-ethyl-3-[8-(9-ethylcarbazol-3-yl)-10-(10-phenylanthracen-9-yl)anthracen-1-yl]carbazole
CID 155333067
9-phenyl-3-[2-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]carbazole
CID 146414179
3-naphthalen-1-yl-9-phenyl-6-[2-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 126764169
6-naphthalen-1-yl-N-[4-[10-[4-(N-(6-naphthalen-1-yl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine
CID 59010589

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole?
The IUPAC name of 9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole (CID 157185828) is 9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole.
What is the SMILES notation for 9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole?
The canonical SMILES for 9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole is CCn1c2ccccc2c2cc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccccc34)ccc21.c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)c3cc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)ccc3n4-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)c3ccccc3n4-c3cnc4ccccc4c3)c3ccccc23)cc1.
What is the InChIKey of 9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole?
The InChIKey is APCKQIAYZRORJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H37N.C41H26N2.C38H27N/c1-4-18-38(19-5-1)55-43-24-10-14-28-47(43)57(48-29-15-11-25-44(48)55)40-32-34-53-51(36-40)52-37-41(33-35-54(52)59(53)42-22-8-3-9-23-42)58-49-30-16-12-26-45(49)56(39-20-6-2-7-21-39)46-27-13-17-31-50(46)58;1-2-12-27(13-3-1)40-32-16-5-7-18-34(32)41(35-19-8-6-17-33(35)40)29-22-23-39-36(25-29)31-15-9-11-21-38(31)43(39)30-24-28-14-4-10-20-37(28)42-26-30;1-2-39-35-21-10-9-15-28(35)34-24-26(22-23-36(34)39)37-30-16-5-7-18-32(30)38(33-19-8-6-17-31(33)37)29-20-11-13-25-12-3-4-14-27(25)29/h1-37H;1-26H;3-24H,2H2,1H3.
What are the key properties of 9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole?
9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole has a molecular weight of 1792.26 g/mol, XLogP of 37.64, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole is sourced from PubChem (CID 157185828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).