3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole

C270H163N11O3S5 — CID 157170070

IUPAC3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole
SMILESc1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c4c2)c2ccccc2n3-c2ccc3sc4ccccc4c3c2)cc1.c1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5ccc6sc7ccccc7c6c5)c4c2)c2ccccc2n3-c2ccc3sc4ccccc4c3c2)cc1.c1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5ccc6sc7ccccc7c6c5)c4c2)c2ccccc2n3-c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5cccc6c5oc5ccccc56)c4c2)c2ccccc2n3-c2ccc3sc4ccccc4c3c2)cc1.c1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5ccccc5)c4c2)c2ccccc2n3-c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C60H37N3S.2C54H32N2OS.C54H32N2S2.C48H30N2O/c1-3-15-38(16-4-1)49-37-58-51(45-21-9-13-25-55(45)63(58)42-29-32-60-52(35-42)47-22-10-14-26-59(47)64-60)36-48(49)39-27-30-46-43-19-7-11-23-53(43)62(57(46)33-39)41-28-31-56-50(34-41)44-20-8-12-24-54(44)61(56)40-17-5-2-6-18-40;1-2-13-33(14-3-1)43-32-50-44(37-16-5-8-20-46(37)55(50)35-26-28-53-45(30-35)40-18-7-11-24-52(40)58-53)31-42(43)34-25-27-38-36-15-4-9-21-47(36)56(49(38)29-34)48-22-12-19-41-39-17-6-10-23-51(39)57-54(41)48;1-2-13-33(14-3-1)43-32-50-44(37-16-5-9-21-47(37)56(50)48-22-12-19-41-39-17-6-10-23-51(39)57-54(41)48)31-42(43)34-25-27-38-36-15-4-8-20-46(36)55(49(38)29-34)35-26-28-53-45(30-35)40-18-7-11-24-52(40)58-53;1-2-12-33(13-3-1)43-32-50-44(38-15-5-9-19-48(38)56(50)36-24-27-54-46(30-36)41-17-7-11-21-52(41)58-54)31-42(43)34-22-25-39-37-14-4-8-18-47(37)55(49(39)28-34)35-23-26-53-45(29-35)40-16-6-10-20-51(40)57-53;1-3-14-31(15-4-1)40-30-46-41(35-19-8-11-23-43(35)50(46)44-24-13-21-38-37-20-9-12-25-47(37)51-48(38)44)29-39(40)32-26-27-36-34-18-7-10-22-42(34)49(45(36)28-32)33-16-5-2-6-17-33/h1-37H;3*1-32H;1-30H
InChIKeyANJAGRUGSLXCLG-UHFFFAOYSA-N
MW3769.68 g/mol
LogP76.71
Rot. Bonds21

About 3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole

3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole (PubChem CID 157170070) has the molecular formula C270H163N11O3S5 and a molecular weight of 3769.68 g/mol. Its IUPAC name is 3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole.

Molecular Properties

Compound Name3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole
PubChem CID157170070
Molecular FormulaC270H163N11O3S5
Molecular Weight3769.68 g/mol
Exact Mass3766.15
IUPAC Name3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole
SMILESc1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c4c2)c2ccccc2n3-c2ccc3sc4ccccc4c3c2)cc1.c1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5ccc6sc7ccccc7c6c5)c4c2)c2ccccc2n3-c2ccc3sc4ccccc4c3c2)cc1.c1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5ccc6sc7ccccc7c6c5)c4c2)c2ccccc2n3-c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5cccc6c5oc5ccccc56)c4c2)c2ccccc2n3-c2ccc3sc4ccccc4c3c2)cc1.c1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5ccccc5)c4c2)c2ccccc2n3-c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C60H37N3S.2C54H32N2OS.C54H32N2S2.C48H30N2O/c1-3-15-38(16-4-1)49-37-58-51(45-21-9-13-25-55(45)63(58)42-29-32-60-52(35-42)47-22-10-14-26-59(47)64-60)36-48(49)39-27-30-46-43-19-7-11-23-53(43)62(57(46)33-39)41-28-31-56-50(34-41)44-20-8-12-24-54(44)61(56)40-17-5-2-6-18-40;1-2-13-33(14-3-1)43-32-50-44(37-16-5-8-20-46(37)55(50)35-26-28-53-45(30-35)40-18-7-11-24-52(40)58-53)31-42(43)34-25-27-38-36-15-4-9-21-47(36)56(49(38)29-34)48-22-12-19-41-39-17-6-10-23-51(39)57-54(41)48;1-2-13-33(14-3-1)43-32-50-44(37-16-5-9-21-47(37)56(50)48-22-12-19-41-39-17-6-10-23-51(39)57-54(41)48)31-42(43)34-25-27-38-36-15-4-8-20-46(36)55(49(38)29-34)35-26-28-53-45(30-35)40-18-7-11-24-52(40)58-53;1-2-12-33(13-3-1)43-32-50-44(38-15-5-9-19-48(38)56(50)36-24-27-54-46(30-36)41-17-7-11-21-52(41)58-54)31-42(43)34-22-25-39-37-14-4-8-18-47(37)55(49(39)28-34)35-23-26-53-45(29-35)40-16-6-10-20-51(40)57-53;1-3-14-31(15-4-1)40-30-46-41(35-19-8-11-23-43(35)50(46)44-24-13-21-38-37-20-9-12-25-47(37)51-48(38)44)29-39(40)32-26-27-36-34-18-7-10-22-42(34)49(45(36)28-32)33-16-5-2-6-17-33/h1-37H;3*1-32H;1-30H
InChIKeyANJAGRUGSLXCLG-UHFFFAOYSA-N
XLogP76.71
TPSA93.65 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds21
Heavy Atoms289
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003769.68
LogP ≤ 576.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze 3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole?
The IUPAC name of 3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole (CID 157170070) is 3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole.
What is the SMILES notation for 3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole?
The canonical SMILES for 3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole is c1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c4c2)c2ccccc2n3-c2ccc3sc4ccccc4c3c2)cc1.c1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5ccc6sc7ccccc7c6c5)c4c2)c2ccccc2n3-c2ccc3sc4ccccc4c3c2)cc1.c1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5ccc6sc7ccccc7c6c5)c4c2)c2ccccc2n3-c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5cccc6c5oc5ccccc56)c4c2)c2ccccc2n3-c2ccc3sc4ccccc4c3c2)cc1.c1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5ccccc5)c4c2)c2ccccc2n3-c2cccc3c2oc2ccccc23)cc1.
What is the InChIKey of 3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole?
The InChIKey is ANJAGRUGSLXCLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H37N3S.2C54H32N2OS.C54H32N2S2.C48H30N2O/c1-3-15-38(16-4-1)49-37-58-51(45-21-9-13-25-55(45)63(58)42-29-32-60-52(35-42)47-22-10-14-26-59(47)64-60)36-48(49)39-27-30-46-43-19-7-11-23-53(43)62(57(46)33-39)41-28-31-56-50(34-41)44-20-8-12-24-54(44)61(56)40-17-5-2-6-18-40;1-2-13-33(14-3-1)43-32-50-44(37-16-5-8-20-46(37)55(50)35-26-28-53-45(30-35)40-18-7-11-24-52(40)58-53)31-42(43)34-25-27-38-36-15-4-9-21-47(36)56(49(38)29-34)48-22-12-19-41-39-17-6-10-23-51(39)57-54(41)48;1-2-13-33(14-3-1)43-32-50-44(37-16-5-9-21-47(37)56(50)48-22-12-19-41-39-17-6-10-23-51(39)57-54(41)48)31-42(43)34-25-27-38-36-15-4-8-20-46(36)55(49(38)29-34)35-26-28-53-45(30-35)40-18-7-11-24-52(40)58-53;1-2-12-33(13-3-1)43-32-50-44(38-15-5-9-19-48(38)56(50)36-24-27-54-46(30-36)41-17-7-11-21-52(41)58-54)31-42(43)34-22-25-39-37-14-4-8-18-47(37)55(49(39)28-34)35-23-26-53-45(29-35)40-16-6-10-20-51(40)57-53;1-3-14-31(15-4-1)40-30-46-41(35-19-8-11-23-43(35)50(46)44-24-13-21-38-37-20-9-12-25-47(37)51-48(38)44)29-39(40)32-26-27-36-34-18-7-10-22-42(34)49(45(36)28-32)33-16-5-2-6-17-33/h1-37H;3*1-32H;1-30H.
What are the key properties of 3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole?
3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole has a molecular weight of 3769.68 g/mol, XLogP of 76.71, 21 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole;9-dibenzofuran-4-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzofuran-4-yl-2-phenyl-3-(9-phenylcarbazol-2-yl)carbazole;9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-2-yl)-2-phenylcarbazole;9-dibenzothiophen-2-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole is sourced from PubChem (CID 157170070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).