7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole

C189H114N12OS — CID 162131598

IUPAC7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole
SMILESCC1(C)c2ccccc2-c2cccc(-c3nc4ccccc4nc3-c3cccc4cc(-n5c6cc(-n7c8ccccc8c8ccc9ccccc9c87)ccc6c6cc7ccccc7cc65)ccc34)c21.c1cc(-n2c3ccccc3c3ccc4ccccc4c32)c2cc3c(cc2c1)c1ccccc1n3-c1cccc2c(-c3nc4ccccc4nc3-c3cccc4oc5ccccc5c34)cccc12.c1cc(-n2c3ccccc3c3ccc4ccccc4c32)c2cc3c(cc2c1)c1ccccc1n3-c1cccc2c(-c3nc4ccccc4nc3-c3cccc4sc5ccccc5c34)cccc12
InChIInChI=1S/C65H42N4.C62H36N4O.C62H36N4S/c1-65(2)55-25-9-7-20-47(55)50-22-14-24-53(61(50)65)63-62(66-56-26-10-11-27-57(56)67-63)51-23-13-18-42-35-43(30-33-45(42)51)68-59-37-41-17-4-3-16-40(41)36-54(59)49-34-31-44(38-60(49)68)69-58-28-12-8-21-48(58)52-32-29-39-15-5-6-19-46(39)64(52)69;2*1-2-17-39-37(15-1)33-34-45-42-18-3-9-28-54(42)66(62(39)45)55-29-11-16-38-35-49-43-19-4-8-27-52(43)65(56(49)36-48(38)55)53-30-13-21-40-41(53)22-12-23-44(40)60-61(64-51-26-7-6-25-50(51)63-60)47-24-14-32-58-59(47)46-20-5-10-31-57(46)67-58/h3-38H,1-2H3;2*1-36H
InChIKeyZISUCLMZQHWCQF-UHFFFAOYSA-N
MW2601.14 g/mol
LogP50.43
Rot. Bonds12

About 7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole

7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole (PubChem CID 162131598) has the molecular formula C189H114N12OS and a molecular weight of 2601.14 g/mol. Its IUPAC name is 7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole.

Molecular Properties

Compound Name7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole
PubChem CID162131598
Molecular FormulaC189H114N12OS
Molecular Weight2601.14 g/mol
Exact Mass2598.90
IUPAC Name7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole
SMILESCC1(C)c2ccccc2-c2cccc(-c3nc4ccccc4nc3-c3cccc4cc(-n5c6cc(-n7c8ccccc8c8ccc9ccccc9c87)ccc6c6cc7ccccc7cc65)ccc34)c21.c1cc(-n2c3ccccc3c3ccc4ccccc4c32)c2cc3c(cc2c1)c1ccccc1n3-c1cccc2c(-c3nc4ccccc4nc3-c3cccc4oc5ccccc5c34)cccc12.c1cc(-n2c3ccccc3c3ccc4ccccc4c32)c2cc3c(cc2c1)c1ccccc1n3-c1cccc2c(-c3nc4ccccc4nc3-c3cccc4sc5ccccc5c34)cccc12
InChIInChI=1S/C65H42N4.C62H36N4O.C62H36N4S/c1-65(2)55-25-9-7-20-47(55)50-22-14-24-53(61(50)65)63-62(66-56-26-10-11-27-57(56)67-63)51-23-13-18-42-35-43(30-33-45(42)51)68-59-37-41-17-4-3-16-40(41)36-54(59)49-34-31-44(38-60(49)68)69-58-28-12-8-21-48(58)52-32-29-39-15-5-6-19-46(39)64(52)69;2*1-2-17-39-37(15-1)33-34-45-42-18-3-9-28-54(42)66(62(39)45)55-29-11-16-38-35-49-43-19-4-8-27-52(43)65(56(49)36-48(38)55)53-30-13-21-40-41(53)22-12-23-44(40)60-61(64-51-26-7-6-25-50(51)63-60)47-24-14-32-58-59(47)46-20-5-10-31-57(46)67-58/h3-38H,1-2H3;2*1-36H
InChIKeyZISUCLMZQHWCQF-UHFFFAOYSA-N
XLogP50.43
TPSA120.06 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds12
Heavy Atoms203
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002601.14
LogP ≤ 550.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole?
The IUPAC name of 7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole (CID 162131598) is 7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole.
What is the SMILES notation for 7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole?
The canonical SMILES for 7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole is CC1(C)c2ccccc2-c2cccc(-c3nc4ccccc4nc3-c3cccc4cc(-n5c6cc(-n7c8ccccc8c8ccc9ccccc9c87)ccc6c6cc7ccccc7cc65)ccc34)c21.c1cc(-n2c3ccccc3c3ccc4ccccc4c32)c2cc3c(cc2c1)c1ccccc1n3-c1cccc2c(-c3nc4ccccc4nc3-c3cccc4oc5ccccc5c34)cccc12.c1cc(-n2c3ccccc3c3ccc4ccccc4c32)c2cc3c(cc2c1)c1ccccc1n3-c1cccc2c(-c3nc4ccccc4nc3-c3cccc4sc5ccccc5c34)cccc12.
What is the InChIKey of 7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole?
The InChIKey is ZISUCLMZQHWCQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H42N4.C62H36N4O.C62H36N4S/c1-65(2)55-25-9-7-20-47(55)50-22-14-24-53(61(50)65)63-62(66-56-26-10-11-27-57(56)67-63)51-23-13-18-42-35-43(30-33-45(42)51)68-59-37-41-17-4-3-16-40(41)36-54(59)49-34-31-44(38-60(49)68)69-58-28-12-8-21-48(58)52-32-29-39-15-5-6-19-46(39)64(52)69;2*1-2-17-39-37(15-1)33-34-45-42-18-3-9-28-54(42)66(62(39)45)55-29-11-16-38-35-49-43-19-4-8-27-52(43)65(56(49)36-48(38)55)53-30-13-21-40-41(53)22-12-23-44(40)60-61(64-51-26-7-6-25-50(51)63-60)47-24-14-32-58-59(47)46-20-5-10-31-57(46)67-58/h3-38H,1-2H3;2*1-36H.
What are the key properties of 7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole?
7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole has a molecular weight of 2601.14 g/mol, XLogP of 50.43, 12 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzofuran-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;7-benzo[a]carbazol-11-yl-5-[5-(3-dibenzothiophen-1-ylquinoxalin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]naphthalen-2-yl]benzo[b]carbazole is sourced from PubChem (CID 162131598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).