1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole

C162H107N9 — CID 161055075

IUPAC1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole
SMILESCC1(C)c2ccccc2-c2c(-c3cccc4c3c3cc5ccccc5cc3n4-c3nc4ccc(-c5ccccc5)cc4nc3-c3ccc4ccccc4c3)cccc21.CC1(C)c2ccccc2-c2c(-c3nc4cc(-c5ccccc5)ccc4nc3-n3c4cc(-c5ccc6ccccc6c5)ccc4c4cc5ccccc5cc43)cccc21.c1ccc(-c2ccc(-c3nc4cc(-c5ccccc5)ccc4nc3-n3c4ccc(-c5ccc6ccccc6c5)cc4c4cc5ccccc5cc43)cc2)cc1
InChIInChI=1S/2C55H37N3.C52H33N3/c1-55(2)45-23-11-10-20-43(45)51-41(21-12-24-46(51)55)42-22-13-25-49-52(42)44-31-37-18-8-9-19-38(37)33-50(44)58(49)54-53(40-27-26-35-16-6-7-17-36(35)30-40)56-48-32-39(28-29-47(48)57-54)34-14-4-3-5-15-34;1-55(2)46-21-11-10-19-43(46)52-44(20-12-22-47(52)55)53-54(57-48-28-26-40(31-49(48)56-53)34-13-4-3-5-14-34)58-50-33-41(39-24-23-35-15-6-7-16-36(35)29-39)25-27-42(50)45-30-37-17-8-9-18-38(37)32-51(45)58;1-3-11-34(12-4-1)37-19-22-38(23-20-37)51-52(54-47-27-25-44(32-48(47)53-51)35-13-5-2-6-14-35)55-49-28-26-43(42-24-21-36-15-7-8-16-39(36)29-42)31-45(49)46-30-40-17-9-10-18-41(40)33-50(46)55/h2*3-33H,1-2H3;1-33H
InChIKeyUCQHCWGMJAWMEU-UHFFFAOYSA-N
MW2179.70 g/mol
LogP42.38
Rot. Bonds13

About 1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole

1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole (PubChem CID 161055075) has the molecular formula C162H107N9 and a molecular weight of 2179.70 g/mol. Its IUPAC name is 1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole.

Molecular Properties

Compound Name1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole
PubChem CID161055075
Molecular FormulaC162H107N9
Molecular Weight2179.70 g/mol
Exact Mass2177.86
IUPAC Name1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole
SMILESCC1(C)c2ccccc2-c2c(-c3cccc4c3c3cc5ccccc5cc3n4-c3nc4ccc(-c5ccccc5)cc4nc3-c3ccc4ccccc4c3)cccc21.CC1(C)c2ccccc2-c2c(-c3nc4cc(-c5ccccc5)ccc4nc3-n3c4cc(-c5ccc6ccccc6c5)ccc4c4cc5ccccc5cc43)cccc21.c1ccc(-c2ccc(-c3nc4cc(-c5ccccc5)ccc4nc3-n3c4ccc(-c5ccc6ccccc6c5)cc4c4cc5ccccc5cc43)cc2)cc1
InChIInChI=1S/2C55H37N3.C52H33N3/c1-55(2)45-23-11-10-20-43(45)51-41(21-12-24-46(51)55)42-22-13-25-49-52(42)44-31-37-18-8-9-19-38(37)33-50(44)58(49)54-53(40-27-26-35-16-6-7-17-36(35)30-40)56-48-32-39(28-29-47(48)57-54)34-14-4-3-5-15-34;1-55(2)46-21-11-10-19-43(46)52-44(20-12-22-47(52)55)53-54(57-48-28-26-40(31-49(48)56-53)34-13-4-3-5-14-34)58-50-33-41(39-24-23-35-15-6-7-16-36(35)29-39)25-27-42(50)45-30-37-17-8-9-18-38(37)32-51(45)58;1-3-11-34(12-4-1)37-19-22-38(23-20-37)51-52(54-47-27-25-44(32-48(47)53-51)35-13-5-2-6-14-35)55-49-28-26-43(42-24-21-36-15-7-8-16-39(36)29-42)31-45(49)46-30-40-17-9-10-18-41(40)33-50(46)55/h2*3-33H,1-2H3;1-33H
InChIKeyUCQHCWGMJAWMEU-UHFFFAOYSA-N
XLogP42.38
TPSA92.13 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds13
Heavy Atoms171
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002179.70
LogP ≤ 542.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole with MolForge

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Related Compounds

5-[3-(9,9-dimethylfluoren-4-yl)-6,7-diphenylquinoxalin-2-yl]benzo[b]carbazole
CID 139361909
2-[2-(9-benzo[b]carbazol-5-ylbenzo[c]carbazol-7-yl)-3-(9,9-dimethylfluoren-2-yl)quinoxalin-6-yl]-9-carbazol-9-yl-7-[3-(9,9-dimethylfluoren-2-yl)quinoxalin-2-yl]benzo[c]carbazole
CID 166846343
5-[4-(9,9-dimethylfluoren-4-yl)-7-phenylquinazolin-2-yl]benzo[b]carbazole
CID 139361929
2-(9,9-dimethylfluoren-2-yl)-5-(3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-naphthalen-2-yl-4-phenylquinazolin-2-yl)-2-triphenylen-2-ylbenzo[b]carbazole;5-(6-naphthalen-2-yl-4-pyridin-4-ylquinazolin-2-yl)-3-(9,9'-spirobi[fluorene]-2-yl)benzo[b]carbazole
CID 159188151
9-(9,9-dimethylfluoren-3-yl)-14-[9-(3-naphthalen-1-ylquinoxalin-2-yl)carbazol-4-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-naphthalen-1-yl-14-[9-(3-naphthalen-1-ylquinoxalin-2-yl)carbazol-4-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-naphthalen-2-yl-14-[9-(3-naphthalen-1-ylquinoxalin-2-yl)carbazol-4-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-[9-(3-naphthalen-2-ylquinoxalin-2-yl)carbazol-2-yl]-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-[9-(3-naphthalen-1-ylquinoxalin-2-yl)carbazol-4-yl]-14-[3-(4-phenylphenyl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 158398649
5-[3,7-diphenyl-6-(4-phenylphenyl)quinoxalin-2-yl]-2-phenylbenzo[b]carbazole
CID 146540047
12-(9,9-dimethylfluoren-2-yl)-16-(3-phenylquinoxalin-2-yl)-12,16-diazahexacyclo[11.11.0.02,11.04,9.015,23.017,22]tetracosa-1(13),2,4,6,8,10,14,17,19,21,23-undecaene
CID 139322555
9-[2-(9,9-dimethylfluoren-4-yl)quinazolin-4-yl]-3-naphthalen-2-ylcarbazole
CID 126537282
7-benzo[c]carbazol-7-yl-5-(3-dibenzofuran-2-ylquinoxalin-2-yl)benzo[b]carbazole;7-benzo[c]carbazol-7-yl-5-[3-(9,9-dimethylfluoren-4-yl)quinoxalin-2-yl]benzo[b]carbazole;7-benzo[c]carbazol-7-yl-5-[3-(9-phenylcarbazol-4-yl)quinoxalin-2-yl]benzo[b]carbazole
CID 159023975
2-[4-[4-[3-dibenzofuran-4-yl-2-[2-[9-[4-[3-dibenzothiophen-4-yl-2-(2-phenylbenzo[b]carbazol-5-yl)quinoxalin-6-yl]phenyl]phenanthren-3-yl]benzo[b]carbazol-5-yl]quinoxalin-6-yl]phenyl]phenyl]-5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]benzo[b]carbazole
CID 146539999
5-(3-phenanthren-2-ylquinoxalin-2-yl)-2-phenylbenzo[b]carbazole
CID 146539824
8-benzo[c]carbazol-7-yl-5-[3-(9,9-dimethylfluoren-2-yl)quinoxalin-2-yl]benzo[b]carbazole
CID 146375005

Frequently Asked Questions

What is the IUPAC name of 1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole?
The IUPAC name of 1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole (CID 161055075) is 1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole.
What is the SMILES notation for 1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole?
The canonical SMILES for 1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole is CC1(C)c2ccccc2-c2c(-c3cccc4c3c3cc5ccccc5cc3n4-c3nc4ccc(-c5ccccc5)cc4nc3-c3ccc4ccccc4c3)cccc21.CC1(C)c2ccccc2-c2c(-c3nc4cc(-c5ccccc5)ccc4nc3-n3c4cc(-c5ccc6ccccc6c5)ccc4c4cc5ccccc5cc43)cccc21.c1ccc(-c2ccc(-c3nc4cc(-c5ccccc5)ccc4nc3-n3c4ccc(-c5ccc6ccccc6c5)cc4c4cc5ccccc5cc43)cc2)cc1.
What is the InChIKey of 1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole?
The InChIKey is UCQHCWGMJAWMEU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C55H37N3.C52H33N3/c1-55(2)45-23-11-10-20-43(45)51-41(21-12-24-46(51)55)42-22-13-25-49-52(42)44-31-37-18-8-9-19-38(37)33-50(44)58(49)54-53(40-27-26-35-16-6-7-17-36(35)30-40)56-48-32-39(28-29-47(48)57-54)34-14-4-3-5-15-34;1-55(2)46-21-11-10-19-43(46)52-44(20-12-22-47(52)55)53-54(57-48-28-26-40(31-49(48)56-53)34-13-4-3-5-14-34)58-50-33-41(39-24-23-35-15-6-7-16-36(35)29-39)25-27-42(50)45-30-37-17-8-9-18-38(37)32-51(45)58;1-3-11-34(12-4-1)37-19-22-38(23-20-37)51-52(54-47-27-25-44(32-48(47)53-51)35-13-5-2-6-14-35)55-49-28-26-43(42-24-21-36-15-7-8-16-39(36)29-42)31-45(49)46-30-40-17-9-10-18-41(40)33-50(46)55/h2*3-33H,1-2H3;1-33H.
What are the key properties of 1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole?
1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole has a molecular weight of 2179.70 g/mol, XLogP of 42.38, 13 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9,9-dimethylfluoren-4-yl)-5-(3-naphthalen-2-yl-6-phenylquinoxalin-2-yl)benzo[b]carbazole;5-[3-(9,9-dimethylfluoren-4-yl)-6-phenylquinoxalin-2-yl]-3-naphthalen-2-ylbenzo[b]carbazole;2-naphthalen-2-yl-5-[6-phenyl-3-(4-phenylphenyl)quinoxalin-2-yl]benzo[b]carbazole is sourced from PubChem (CID 161055075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).