3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole

C144H90N6O2S — CID 159327948

IUPAC3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole
SMILESc1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3oc4ccccc4c23)c1.c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3sc4ccccc4c23)c1.c1ccc(-c2cc(-c3ccc4c(c3)c3ccccc3n4-c3cccc4oc5ccccc5c34)cc(-n3c4ccccc4c4ccccc43)c2)cc1
InChIInChI=1S/2C48H30N2O.C48H30N2S/c1-5-20-41-36(16-1)37-17-2-6-21-42(37)49(41)35-15-10-14-33(29-35)31-12-9-13-32(28-31)34-26-27-44-40(30-34)38-18-3-7-22-43(38)50(44)45-23-11-25-47-48(45)39-19-4-8-24-46(39)51-47;1-2-13-31(14-3-1)33-27-34(29-35(28-33)49-41-19-8-4-15-36(41)37-16-5-9-20-42(37)49)32-25-26-44-40(30-32)38-17-6-10-21-43(38)50(44)45-22-12-24-47-48(45)39-18-7-11-23-46(39)51-47;1-5-20-41-36(16-1)37-17-2-6-21-42(37)49(41)35-15-10-14-33(29-35)31-12-9-13-32(28-31)34-26-27-44-40(30-34)38-18-3-7-22-43(38)50(44)45-23-11-25-47-48(45)39-19-4-8-24-46(39)51-47/h3*1-30H
InChIKeyLEPLLJAILIVXMH-UHFFFAOYSA-N
MW1968.41 g/mol
LogP39.81
Rot. Bonds12

About 3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole

3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole (PubChem CID 159327948) has the molecular formula C144H90N6O2S and a molecular weight of 1968.41 g/mol. Its IUPAC name is 3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole.

Molecular Properties

Compound Name3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole
PubChem CID159327948
Molecular FormulaC144H90N6O2S
Molecular Weight1968.41 g/mol
Exact Mass1966.68
IUPAC Name3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole
SMILESc1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3oc4ccccc4c23)c1.c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3sc4ccccc4c23)c1.c1ccc(-c2cc(-c3ccc4c(c3)c3ccccc3n4-c3cccc4oc5ccccc5c34)cc(-n3c4ccccc4c4ccccc43)c2)cc1
InChIInChI=1S/2C48H30N2O.C48H30N2S/c1-5-20-41-36(16-1)37-17-2-6-21-42(37)49(41)35-15-10-14-33(29-35)31-12-9-13-32(28-31)34-26-27-44-40(30-34)38-18-3-7-22-43(38)50(44)45-23-11-25-47-48(45)39-19-4-8-24-46(39)51-47;1-2-13-31(14-3-1)33-27-34(29-35(28-33)49-41-19-8-4-15-36(41)37-16-5-9-20-42(37)49)32-25-26-44-40(30-32)38-17-6-10-21-43(38)50(44)45-22-12-24-47-48(45)39-18-7-11-23-46(39)51-47;1-5-20-41-36(16-1)37-17-2-6-21-42(37)49(41)35-15-10-14-33(29-35)31-12-9-13-32(28-31)34-26-27-44-40(30-34)38-18-3-7-22-43(38)50(44)45-23-11-25-47-48(45)39-19-4-8-24-46(39)51-47/h3*1-30H
InChIKeyLEPLLJAILIVXMH-UHFFFAOYSA-N
XLogP39.81
TPSA55.86 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds12
Heavy Atoms153
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001968.41
LogP ≤ 539.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole with MolForge

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Related Compounds

3-[4-(9-dibenzothiophen-1-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole
CID 118148116
3-(9-dibenzothiophen-1-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-(8-phenyldibenzothiophen-1-yl)carbazole
CID 165095044
3-(9-dibenzofuran-1-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-phenylcarbazole
CID 161380088
9-dibenzofuran-1-yl-2-phenyl-6-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 90310026
9-dibenzothiophen-1-yl-14-(3-phenylphenyl)-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 166961335
3-(9-phenylcarbazol-3-yl)-9-(8-phenyldibenzofuran-1-yl)carbazole
CID 164821289
3-[3-(9-dibenzofuran-1-ylcarbazol-3-yl)-1-benzothiophen-2-yl]-9-dibenzothiophen-1-ylcarbazole
CID 90291742
3-(9-dibenzofuran-1-ylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-(9-dibenzofuran-4-ylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-[9-(4-phenyldibenzothiophen-2-yl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 163611477
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
3-(9-phenylcarbazol-3-yl)-9-(7-phenyldibenzofuran-1-yl)carbazole
CID 168850152
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
9-dibenzofuran-1-yl-14-(3,5-diphenylphenyl)-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 171414752

Frequently Asked Questions

What is the IUPAC name of 3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole?
The IUPAC name of 3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole (CID 159327948) is 3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole.
What is the SMILES notation for 3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole?
The canonical SMILES for 3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole is c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3oc4ccccc4c23)c1.c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3sc4ccccc4c23)c1.c1ccc(-c2cc(-c3ccc4c(c3)c3ccccc3n4-c3cccc4oc5ccccc5c34)cc(-n3c4ccccc4c4ccccc43)c2)cc1.
What is the InChIKey of 3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole?
The InChIKey is LEPLLJAILIVXMH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C48H30N2O.C48H30N2S/c1-5-20-41-36(16-1)37-17-2-6-21-42(37)49(41)35-15-10-14-33(29-35)31-12-9-13-32(28-31)34-26-27-44-40(30-34)38-18-3-7-22-43(38)50(44)45-23-11-25-47-48(45)39-19-4-8-24-46(39)51-47;1-2-13-31(14-3-1)33-27-34(29-35(28-33)49-41-19-8-4-15-36(41)37-16-5-9-20-42(37)49)32-25-26-44-40(30-32)38-17-6-10-21-43(38)50(44)45-22-12-24-47-48(45)39-18-7-11-23-46(39)51-47;1-5-20-41-36(16-1)37-17-2-6-21-42(37)49(41)35-15-10-14-33(29-35)31-12-9-13-32(28-31)34-26-27-44-40(30-34)38-18-3-7-22-43(38)50(44)45-23-11-25-47-48(45)39-19-4-8-24-46(39)51-47/h3*1-30H.
What are the key properties of 3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole?
3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole has a molecular weight of 1968.41 g/mol, XLogP of 39.81, 12 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzofuran-1-ylcarbazole;3-(3-carbazol-9-yl-5-phenylphenyl)-9-dibenzofuran-1-ylcarbazole;3-[3-(3-carbazol-9-ylphenyl)phenyl]-9-dibenzothiophen-1-ylcarbazole is sourced from PubChem (CID 159327948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).