5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole

C144H87N9O2S — CID 161274836

IUPAC5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole
SMILESc1ccc(-c2cc3nc(-c4ccccc4)c(-n4c5ccccc5c5cc6ccccc6cc54)nc3cc2-c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2cc3nc(-n4c5ccccc5c5cc6ccccc6cc54)c(-c4ccccc4)nc3cc2-c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2cc3nc(-n4c5ccccc5c5cc6ccccc6cc54)c(-c4ccccc4)nc3cc2-c2cccc3c2sc2ccccc23)cc1
InChIInChI=1S/2C48H29N3O.C48H29N3S/c1-3-14-30(15-4-1)38-28-42-41(29-39(38)37-23-13-22-36-35-21-10-12-25-45(35)52-47(36)37)49-46(31-16-5-2-6-17-31)48(50-42)51-43-24-11-9-20-34(43)40-26-32-18-7-8-19-33(32)27-44(40)51;1-3-14-30(15-4-1)38-28-41-42(29-39(38)37-23-13-22-36-35-21-10-12-25-45(35)52-47(36)37)50-48(46(49-41)31-16-5-2-6-17-31)51-43-24-11-9-20-34(43)40-26-32-18-7-8-19-33(32)27-44(40)51;1-3-14-30(15-4-1)38-28-42-41(29-39(38)37-23-13-22-36-35-21-10-12-25-45(35)52-47(36)37)49-46(31-16-5-2-6-17-31)48(50-42)51-43-24-11-9-20-34(43)40-26-32-18-7-8-19-33(32)27-44(40)51/h3*1-29H
InChIKeyVEHJWYNMCOWAFP-UHFFFAOYSA-N
MW2007.41 g/mol
LogP38.81
Rot. Bonds12

About 5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole

5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole (PubChem CID 161274836) has the molecular formula C144H87N9O2S and a molecular weight of 2007.41 g/mol. Its IUPAC name is 5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole.

Molecular Properties

Compound Name5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole
PubChem CID161274836
Molecular FormulaC144H87N9O2S
Molecular Weight2007.41 g/mol
Exact Mass2005.67
IUPAC Name5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole
SMILESc1ccc(-c2cc3nc(-c4ccccc4)c(-n4c5ccccc5c5cc6ccccc6cc54)nc3cc2-c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2cc3nc(-n4c5ccccc5c5cc6ccccc6cc54)c(-c4ccccc4)nc3cc2-c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2cc3nc(-n4c5ccccc5c5cc6ccccc6cc54)c(-c4ccccc4)nc3cc2-c2cccc3c2sc2ccccc23)cc1
InChIInChI=1S/2C48H29N3O.C48H29N3S/c1-3-14-30(15-4-1)38-28-42-41(29-39(38)37-23-13-22-36-35-21-10-12-25-45(35)52-47(36)37)49-46(31-16-5-2-6-17-31)48(50-42)51-43-24-11-9-20-34(43)40-26-32-18-7-8-19-33(32)27-44(40)51;1-3-14-30(15-4-1)38-28-41-42(29-39(38)37-23-13-22-36-35-21-10-12-25-45(35)52-47(36)37)50-48(46(49-41)31-16-5-2-6-17-31)51-43-24-11-9-20-34(43)40-26-32-18-7-8-19-33(32)27-44(40)51;1-3-14-30(15-4-1)38-28-42-41(29-39(38)37-23-13-22-36-35-21-10-12-25-45(35)52-47(36)37)49-46(31-16-5-2-6-17-31)48(50-42)51-43-24-11-9-20-34(43)40-26-32-18-7-8-19-33(32)27-44(40)51/h3*1-29H
InChIKeyVEHJWYNMCOWAFP-UHFFFAOYSA-N
XLogP38.81
TPSA118.41 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds12
Heavy Atoms156
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002007.41
LogP ≤ 538.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole with MolForge

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Related Compounds

5-(7-dibenzothiophen-4-yl-3,6-diphenylquinoxalin-2-yl)-3-naphthalen-2-ylbenzo[b]carbazole;5-[3,7-diphenyl-6-(9-phenylcarbazol-2-yl)quinoxalin-2-yl]-3-phenylbenzo[b]carbazole;5-[3,6-diphenyl-7-(9-phenylcarbazol-2-yl)quinoxalin-2-yl]-3-(4-phenylphenyl)benzo[b]carbazole
CID 161023733
5-(7-dibenzofuran-4-yl-4,6-diphenylquinazolin-2-yl)benzo[b]carbazole;5-(7-dibenzothiophen-4-yl-4,6-diphenylquinazolin-2-yl)benzo[b]carbazole;5-[4-phenyl-7-(9-phenylcarbazol-3-yl)quinazolin-2-yl]benzo[b]carbazole
CID 161482965
10-benzo[b]carbazol-5-yl-5-(3-dibenzofuran-4-ylquinoxalin-2-yl)benzo[b]carbazole;10-benzo[b]carbazol-5-yl-5-(3-dibenzothiophen-4-ylquinoxalin-2-yl)benzo[b]carbazole;10-benzo[b]carbazol-5-yl-5-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]benzo[b]carbazole
CID 160503280
4-dibenzofuran-4-yl-5-(3-phenylquinoxalin-2-yl)benzo[b]carbazole
CID 142569867
5-(6-dibenzofuran-4-yl-4,7-diphenylquinazolin-2-yl)benzo[b]carbazole
CID 139361732
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-dibenzofuran-4-yl-4-(4-dibenzothiophen-1-yl-6-dibenzothiophen-4-yl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole
CID 155430958
5-[10-(4-dibenzofuran-4-yl-6-dibenzothiophen-4-yl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]benzo[b]carbazole
CID 167347699
5-[9-(4-dibenzofuran-4-yl-6-dibenzothiophen-4-yl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-7-yl]benzo[b]carbazole
CID 166700217
5-[2-[4-dibenzothiophen-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]benzo[b]carbazole
CID 155043007
5-[4-[4-dibenzothiophen-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-1-yl]benzo[b]carbazole
CID 166699331
4-phenyl-7-(3-phenylquinoxalin-2-yl)-[1]benzofuro[2,3-b]carbazole
CID 129290215

Frequently Asked Questions

What is the IUPAC name of 5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole?
The IUPAC name of 5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole (CID 161274836) is 5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole.
What is the SMILES notation for 5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole?
The canonical SMILES for 5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole is c1ccc(-c2cc3nc(-c4ccccc4)c(-n4c5ccccc5c5cc6ccccc6cc54)nc3cc2-c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2cc3nc(-n4c5ccccc5c5cc6ccccc6cc54)c(-c4ccccc4)nc3cc2-c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2cc3nc(-n4c5ccccc5c5cc6ccccc6cc54)c(-c4ccccc4)nc3cc2-c2cccc3c2sc2ccccc23)cc1.
What is the InChIKey of 5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole?
The InChIKey is VEHJWYNMCOWAFP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C48H29N3O.C48H29N3S/c1-3-14-30(15-4-1)38-28-42-41(29-39(38)37-23-13-22-36-35-21-10-12-25-45(35)52-47(36)37)49-46(31-16-5-2-6-17-31)48(50-42)51-43-24-11-9-20-34(43)40-26-32-18-7-8-19-33(32)27-44(40)51;1-3-14-30(15-4-1)38-28-41-42(29-39(38)37-23-13-22-36-35-21-10-12-25-45(35)52-47(36)37)50-48(46(49-41)31-16-5-2-6-17-31)51-43-24-11-9-20-34(43)40-26-32-18-7-8-19-33(32)27-44(40)51;1-3-14-30(15-4-1)38-28-42-41(29-39(38)37-23-13-22-36-35-21-10-12-25-45(35)52-47(36)37)49-46(31-16-5-2-6-17-31)48(50-42)51-43-24-11-9-20-34(43)40-26-32-18-7-8-19-33(32)27-44(40)51/h3*1-29H.
What are the key properties of 5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole?
5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole has a molecular weight of 2007.41 g/mol, XLogP of 38.81, 12 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-dibenzofuran-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(7-dibenzofuran-4-yl-3,6-diphenylquinoxalin-2-yl)benzo[b]carbazole;5-(6-dibenzothiophen-4-yl-3,7-diphenylquinoxalin-2-yl)benzo[b]carbazole is sourced from PubChem (CID 161274836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).