3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole

C164H107N9O — CID 160862721

IUPAC3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-n5c6ccccc6c6ccccc65)ccc43)c2)cc1.c1ccc(Cc2ccc3c(c2)c2cc(-c4ccc5c(c4)c4cc(Cc6ccccc6)ccc4n5-n4c5ccccc5c5ccccc54)ccc2n3-c2ccccc2)cc1.c1ccc2c(c1)oc1c(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-n6c7ccccc7c7ccccc76)ccc54)cc3)cccc12
InChIInChI=1S/C56H39N3.C54H33N3O.C54H35N3/c1-4-14-38(15-5-1)32-40-24-28-51-47(34-40)49-36-42(26-30-52(49)57(51)44-18-8-3-9-19-44)43-27-31-56-50(37-43)48-35-41(33-39-16-6-2-7-17-39)25-29-55(48)59(56)58-53-22-12-10-20-45(53)46-21-11-13-23-54(46)58;1-6-19-47-41(14-1)45-32-35(26-30-48(45)55(47)37-28-24-34(25-29-37)38-17-11-18-44-43-16-5-10-23-53(43)58-54(38)44)36-27-31-52-46(33-36)42-15-4-9-22-51(42)57(52)56-49-20-7-2-12-39(49)40-13-3-8-21-50(40)56;1-3-15-36(16-4-1)40-31-41(37-17-5-2-6-18-37)33-42(32-40)55-49-23-11-7-21-45(49)47-34-38(27-29-50(47)55)39-28-30-54-48(35-39)46-22-10-14-26-53(46)57(54)56-51-24-12-8-19-43(51)44-20-9-13-25-52(44)56/h1-31,34-37H,32-33H2;1-33H;1-35H
InChIKeySKRWEDKMZRJHNF-UHFFFAOYSA-N
MW2219.72 g/mol
LogP43.02
Rot. Bonds16

About 3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole

3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole (PubChem CID 160862721) has the molecular formula C164H107N9O and a molecular weight of 2219.72 g/mol. Its IUPAC name is 3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole.

Molecular Properties

Compound Name3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole
PubChem CID160862721
Molecular FormulaC164H107N9O
Molecular Weight2219.72 g/mol
Exact Mass2217.86
IUPAC Name3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-n5c6ccccc6c6ccccc65)ccc43)c2)cc1.c1ccc(Cc2ccc3c(c2)c2cc(-c4ccc5c(c4)c4cc(Cc6ccccc6)ccc4n5-n4c5ccccc5c5ccccc54)ccc2n3-c2ccccc2)cc1.c1ccc2c(c1)oc1c(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-n6c7ccccc7c7ccccc76)ccc54)cc3)cccc12
InChIInChI=1S/C56H39N3.C54H33N3O.C54H35N3/c1-4-14-38(15-5-1)32-40-24-28-51-47(34-40)49-36-42(26-30-52(49)57(51)44-18-8-3-9-19-44)43-27-31-56-50(37-43)48-35-41(33-39-16-6-2-7-17-39)25-29-55(48)59(56)58-53-22-12-10-20-45(53)46-21-11-13-23-54(46)58;1-6-19-47-41(14-1)45-32-35(26-30-48(45)55(47)37-28-24-34(25-29-37)38-17-11-18-44-43-16-5-10-23-53(43)58-54(38)44)36-27-31-52-46(33-36)42-15-4-9-22-51(42)57(52)56-49-20-7-2-12-39(49)40-13-3-8-21-50(40)56;1-3-15-36(16-4-1)40-31-41(37-17-5-2-6-18-37)33-42(32-40)55-49-23-11-7-21-45(49)47-34-38(27-29-50(47)55)39-28-30-54-48(35-39)46-22-10-14-26-53(46)57(54)56-51-24-12-8-19-43(51)44-20-9-13-25-52(44)56/h1-31,34-37H,32-33H2;1-33H;1-35H
InChIKeySKRWEDKMZRJHNF-UHFFFAOYSA-N
XLogP43.02
TPSA57.51 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds16
Heavy Atoms174
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002219.72
LogP ≤ 543.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole with MolForge

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Related Compounds

3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 134313296
3-[3-[3-(4-dibenzofuran-4-ylphenyl)phenyl]phenyl]-9-phenylcarbazole
CID 121262432
9-phenyl-3-[3-(6-phenyldibenzofuran-2-yl)-5-(4-phenylphenyl)phenyl]carbazole
CID 122492344
3-dibenzofuran-4-yl-9-(3-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 121449361
4-(4-bromophenyl)dibenzofuran;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 158714965
3-[8-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 137474197
3-(3-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole
CID 137466609
12-(4-carbazol-9-ylphenyl)-11-phenylindolo[2,3-a]carbazole;12-(4-dibenzofuran-4-ylphenyl)-11-phenylindolo[2,3-a]carbazole;11,12-diphenyl-3-(9-phenylcarbazol-3-yl)indolo[2,3-a]carbazole;methane
CID 158881959
11-(4-dibenzofuran-4-ylphenyl)-3,5-diphenylindolo[3,2-b]carbazole
CID 126580169
12-(4-dibenzofuran-4-ylphenyl)-3,8,11-triphenylindolo[2,3-a]carbazole
CID 90191500
2-dibenzofuran-4-yl-5,7-diphenylindolo[2,3-b]carbazole;5-(4-dibenzofuran-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole;5,7-diphenyl-2-(9-phenylcarbazol-3-yl)indolo[2,3-b]carbazole
CID 160885475
9-phenyl-3-[3-(6-phenyldibenzofuran-4-yl)-5-(3-phenylphenyl)phenyl]carbazole;9-phenyl-3-[3-(6-phenyldibenzofuran-4-yl)-5-(4-phenylphenyl)phenyl]carbazole
CID 159217991

Frequently Asked Questions

What is the IUPAC name of 3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole?
The IUPAC name of 3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole (CID 160862721) is 3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole.
What is the SMILES notation for 3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole?
The canonical SMILES for 3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole is c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-n5c6ccccc6c6ccccc65)ccc43)c2)cc1.c1ccc(Cc2ccc3c(c2)c2cc(-c4ccc5c(c4)c4cc(Cc6ccccc6)ccc4n5-n4c5ccccc5c5ccccc54)ccc2n3-c2ccccc2)cc1.c1ccc2c(c1)oc1c(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-n6c7ccccc7c7ccccc76)ccc54)cc3)cccc12.
What is the InChIKey of 3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole?
The InChIKey is SKRWEDKMZRJHNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H39N3.C54H33N3O.C54H35N3/c1-4-14-38(15-5-1)32-40-24-28-51-47(34-40)49-36-42(26-30-52(49)57(51)44-18-8-3-9-19-44)43-27-31-56-50(37-43)48-35-41(33-39-16-6-2-7-17-39)25-29-55(48)59(56)58-53-22-12-10-20-45(53)46-21-11-13-23-54(46)58;1-6-19-47-41(14-1)45-32-35(26-30-48(45)55(47)37-28-24-34(25-29-37)38-17-11-18-44-43-16-5-10-23-53(43)58-54(38)44)36-27-31-52-46(33-36)42-15-4-9-22-51(42)57(52)56-49-20-7-2-12-39(49)40-13-3-8-21-50(40)56;1-3-15-36(16-4-1)40-31-41(37-17-5-2-6-18-37)33-42(32-40)55-49-23-11-7-21-45(49)47-34-38(27-29-50(47)55)39-28-30-54-48(35-39)46-22-10-14-26-53(46)57(54)56-51-24-12-8-19-43(51)44-20-9-13-25-52(44)56/h1-31,34-37H,32-33H2;1-33H;1-35H.
What are the key properties of 3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole?
3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole has a molecular weight of 2219.72 g/mol, XLogP of 43.02, 16 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzyl-6-(6-benzyl-9-carbazol-9-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(4-dibenzofuran-4-ylphenyl)carbazole;3-(9-carbazol-9-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole is sourced from PubChem (CID 160862721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).