9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene

C165H97N9O4S2 — CID 158952349

IUPAC9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
SMILESc1cc(-c2cc(-c3ccc4oc5ccccc5c4c3)cc(-n3c4ccccc4c4ccccc43)c2)cc(-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c1.c1ccc2c(c1)oc1ccc(-c3cc(-c4ccc5oc6ccc(-n7c8ccccc8c8ccncc87)cc6c5c4)cc(-n4c5ccccc5c5ccccc54)c3)cc12.c1ccc2c(c1)sc1ccc(-c3cc(-c4ccc5sc6ccc(-n7c8cccnc8c8ncccc87)cc6c5c4)cc(-n4c5ccccc5c5ccccc54)c3)cc12
InChIInChI=1S/C60H36N2O2.C53H31N3O2.C52H30N4S2/c1-6-19-53-45(14-1)46-15-2-7-20-54(46)61(53)43-26-29-60-52(36-43)51-34-39(24-27-59(51)64-60)37-12-11-13-38(30-37)41-31-42(40-25-28-58-50(35-40)49-18-5-10-23-57(49)63-58)33-44(32-41)62-55-21-8-3-16-47(55)48-17-4-9-22-56(48)62;1-6-14-47-38(9-1)39-10-2-7-15-48(39)56(47)37-26-34(32-17-20-51-43(28-32)42-12-4-8-16-50(42)57-51)25-35(27-37)33-18-21-52-44(29-33)45-30-36(19-22-53(45)58-52)55-46-13-5-3-11-40(46)41-23-24-54-31-49(41)55;1-4-12-43-37(9-1)38-10-2-5-13-44(38)56(43)36-26-33(31-17-20-48-40(28-31)39-11-3-6-16-47(39)57-48)25-34(27-36)32-18-21-49-41(29-32)42-30-35(19-22-50(42)58-49)55-45-14-7-23-53-51(45)52-46(55)15-8-24-54-52/h1-36H;1-31H;1-30H
InChIKeyJLOYLDIJOCIZAK-UHFFFAOYSA-N
MW2333.78 g/mol
LogP45.83
Rot. Bonds13

About 9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene

9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene (PubChem CID 158952349) has the molecular formula C165H97N9O4S2 and a molecular weight of 2333.78 g/mol. Its IUPAC name is 9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene.

Molecular Properties

Compound Name9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
PubChem CID158952349
Molecular FormulaC165H97N9O4S2
Molecular Weight2333.78 g/mol
Exact Mass2331.71
IUPAC Name9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
SMILESc1cc(-c2cc(-c3ccc4oc5ccccc5c4c3)cc(-n3c4ccccc4c4ccccc43)c2)cc(-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c1.c1ccc2c(c1)oc1ccc(-c3cc(-c4ccc5oc6ccc(-n7c8ccccc8c8ccncc87)cc6c5c4)cc(-n4c5ccccc5c5ccccc54)c3)cc12.c1ccc2c(c1)sc1ccc(-c3cc(-c4ccc5sc6ccc(-n7c8cccnc8c8ncccc87)cc6c5c4)cc(-n4c5ccccc5c5ccccc54)c3)cc12
InChIInChI=1S/C60H36N2O2.C53H31N3O2.C52H30N4S2/c1-6-19-53-45(14-1)46-15-2-7-20-54(46)61(53)43-26-29-60-52(36-43)51-34-39(24-27-59(51)64-60)37-12-11-13-38(30-37)41-31-42(40-25-28-58-50(35-40)49-18-5-10-23-57(49)63-58)33-44(32-41)62-55-21-8-3-16-47(55)48-17-4-9-22-56(48)62;1-6-14-47-38(9-1)39-10-2-7-15-48(39)56(47)37-26-34(32-17-20-51-43(28-32)42-12-4-8-16-50(42)57-51)25-35(27-37)33-18-21-52-44(29-33)45-30-36(19-22-53(45)58-52)55-46-13-5-3-11-40(46)41-23-24-54-31-49(41)55;1-4-12-43-37(9-1)38-10-2-5-13-44(38)56(43)36-26-33(31-17-20-48-40(28-31)39-11-3-6-16-47(39)57-48)25-34(27-36)32-18-21-49-41(29-32)42-30-35(19-22-50(42)58-49)55-45-14-7-23-53-51(45)52-46(55)15-8-24-54-52/h1-36H;1-31H;1-30H
InChIKeyJLOYLDIJOCIZAK-UHFFFAOYSA-N
XLogP45.83
TPSA120.81 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds13
Heavy Atoms180
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002333.78
LogP ≤ 545.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene with MolForge

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Related Compounds

9-[3-dibenzofuran-2-yl-5-(3-dibenzofuran-2-ylphenyl)phenyl]carbazole;9-[3-(3-dibenzothiophen-2-ylphenyl)phenyl]carbazole;9-[4-[3-phenyl-5-(8-phenyldibenzofuran-2-yl)phenyl]phenyl]carbazole
CID 162190539
2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)dibenzofuran;9-[3,5-di(dibenzofuran-2-yl)phenyl]carbazole;2-[3,5-di(dibenzothiophen-2-yl)phenyl]dibenzofuran
CID 162164697
9-[8-[3-(8-pyrido[3,4-b]indol-9-yldibenzofuran-2-yl)phenyl]dibenzofuran-2-yl]pyrido[3,4-b]indole
CID 58038552
8-[3-[3-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]phenyl]phenyl]-[1]benzofuro[3,2-c]pyridine;5-[3-[3-[8-[3-(9-phenylcarbazol-3-yl)phenyl]dibenzothiophen-2-yl]phenyl]phenyl]pyrido[3,2-b]indole;5-[3-[3-[8-(3-pyrido[3,2-b]indol-5-ylphenyl)dibenzofuran-2-yl]phenyl]phenyl]pyrido[3,2-b]indole;5-[3-[3-[3-(3-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]phenyl]pyrido[3,2-b]indole
CID 157389603
3-[9-(3-dibenzofuran-2-ylphenyl)carbazol-3-yl]-9-dibenzothiophen-2-ylcarbazole
CID 155305717
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole;3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole;3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 159055285
9-dibenzofuran-2-yl-3-dibenzothiophen-2-ylcarbazole;3-dibenzofuran-2-yl-9-(3-phenylphenyl)carbazole;3,9-di(dibenzothiophen-2-yl)carbazole
CID 158258330
3-dibenzofuran-2-yl-9-(3,5-diphenylphenyl)carbazole;3-dibenzothiophen-2-yl-9-(3,5-diphenylphenyl)carbazole;3-dibenzothiophen-2-yl-9-(4-phenylphenyl)carbazole
CID 160571144
5-[5-(8-carbazol-9-yldibenzofuran-2-yl)-3-pyridinyl]pyrido[4,3-b]indole;9-[5-(8-carbazol-9-yldibenzothiophen-2-yl)-3-pyridinyl]carbazole;5-[8-(5-carbazol-9-yl-3-pyridinyl)dibenzofuran-2-yl]pyrido[4,3-b]indole;9-[8-(6-dibenzofuran-2-yl-2-pyridinyl)dibenzofuran-2-yl]carbazole;9-[8-(6-dibenzothiophen-2-yl-2-pyridinyl)dibenzofuran-2-yl]carbazole
CID 159862804
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(8-phenyldibenzofuran-2-yl)carbazole;3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(8-phenyldibenzothiophen-2-yl)carbazole;9-(8-phenyldibenzothiophen-2-yl)-3-[9-(8-phenyldibenzothiophen-2-yl)carbazol-3-yl]carbazole
CID 161271655
9-(8-carbazol-9-yldibenzofuran-2-yl)-3-[3-[9-(8-carbazol-9-yldibenzofuran-2-yl)carbazol-3-yl]phenyl]carbazole;9-(8-carbazol-9-yldibenzofuran-2-yl)-3-[3-(3-dibenzofuran-2-ylphenyl)phenyl]carbazole;9-(8-carbazol-9-yldibenzothiophen-2-yl)-3-(4-dibenzofuran-2-ylphenyl)carbazole;3,6-diphenyl-9-[8-(3-phenylcarbazol-9-yl)dibenzofuran-2-yl]carbazole
CID 160619262
3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-9-[8-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]carbazol-9-yl]dibenzothiophen-2-yl]carbazole
CID 152935569

Frequently Asked Questions

What is the IUPAC name of 9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
The IUPAC name of 9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene (CID 158952349) is 9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene.
What is the SMILES notation for 9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
The canonical SMILES for 9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene is c1cc(-c2cc(-c3ccc4oc5ccccc5c4c3)cc(-n3c4ccccc4c4ccccc43)c2)cc(-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c1.c1ccc2c(c1)oc1ccc(-c3cc(-c4ccc5oc6ccc(-n7c8ccccc8c8ccncc87)cc6c5c4)cc(-n4c5ccccc5c5ccccc54)c3)cc12.c1ccc2c(c1)sc1ccc(-c3cc(-c4ccc5sc6ccc(-n7c8cccnc8c8ncccc87)cc6c5c4)cc(-n4c5ccccc5c5ccccc54)c3)cc12.
What is the InChIKey of 9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
The InChIKey is JLOYLDIJOCIZAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H36N2O2.C53H31N3O2.C52H30N4S2/c1-6-19-53-45(14-1)46-15-2-7-20-54(46)61(53)43-26-29-60-52(36-43)51-34-39(24-27-59(51)64-60)37-12-11-13-38(30-37)41-31-42(40-25-28-58-50(35-40)49-18-5-10-23-57(49)63-58)33-44(32-41)62-55-21-8-3-16-47(55)48-17-4-9-22-56(48)62;1-6-14-47-38(9-1)39-10-2-7-15-48(39)56(47)37-26-34(32-17-20-51-43(28-32)42-12-4-8-16-50(42)57-51)25-35(27-37)33-18-21-52-44(29-33)45-30-36(19-22-53(45)58-52)55-46-13-5-3-11-40(46)41-23-24-54-31-49(41)55;1-4-12-43-37(9-1)38-10-2-5-13-44(38)56(43)36-26-33(31-17-20-48-40(28-31)39-11-3-6-16-47(39)57-48)25-34(27-36)32-18-21-49-41(29-32)42-30-35(19-22-50(42)58-49)55-45-14-7-23-53-51(45)52-46(55)15-8-24-54-52/h1-36H;1-31H;1-30H.
What are the key properties of 9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene has a molecular weight of 2333.78 g/mol, XLogP of 45.83, 13 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole;9-[8-(3-carbazol-9-yl-5-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]pyrido[3,4-b]indole;8-[8-(3-carbazol-9-yl-5-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene is sourced from PubChem (CID 158952349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).