9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole

C54H32N2O2 — CID 90348741

IUPAC9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole
SMILESc1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5cccc6c5oc5ccccc56)c4c2)c2ccccc2n3-c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C54H32N2O2/c1-2-14-33(15-3-1)43-32-50-44(36-17-5-9-23-46(36)56(50)48-25-13-21-41-39-19-7-11-27-52(39)58-54(41)48)31-42(43)34-28-29-37-35-16-4-8-22-45(35)55(49(37)30-34)47-24-12-20-40-38-18-6-10-26-51(38)57-53(40)47/h1-32H
InChIKeyBTNRJYBQUMRNLA-UHFFFAOYSA-N
MW740.86 g/mol
LogP15.01
Rot. Bonds4

About 9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole

9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole (PubChem CID 90348741) has the molecular formula C54H32N2O2 and a molecular weight of 740.86 g/mol. Its IUPAC name is 9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole.

Molecular Properties

Compound Name9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole
PubChem CID90348741
Molecular FormulaC54H32N2O2
Molecular Weight740.86 g/mol
Exact Mass740.25
IUPAC Name9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole
SMILESc1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5cccc6c5oc5ccccc56)c4c2)c2ccccc2n3-c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C54H32N2O2/c1-2-14-33(15-3-1)43-32-50-44(36-17-5-9-23-46(36)56(50)48-25-13-21-41-39-19-7-11-27-52(39)58-54(41)48)31-42(43)34-28-29-37-35-16-4-8-22-45(35)55(49(37)30-34)47-24-12-20-40-38-18-6-10-26-51(38)57-53(40)47/h1-32H
InChIKeyBTNRJYBQUMRNLA-UHFFFAOYSA-N
XLogP15.01
TPSA36.14 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500740.86
LogP ≤ 515.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole 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

9-dibenzofuran-4-yl-3-phenyl-2-(9-phenylcarbazol-2-yl)carbazole
CID 90321642
9-dibenzofuran-4-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole
CID 90348740
3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-dibenzothiophen-2-yl-2-phenylcarbazole
CID 90321576
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
6-(9-dibenzofuran-4-ylcarbazol-3-yl)-2,9-diphenylcarbazole
CID 170072505
2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole
CID 118505930
9-(8-dibenzofuran-3-yldibenzofuran-4-yl)-3-phenylcarbazole
CID 147201109
3-(6-carbazol-9-yldibenzofuran-2-yl)-9-dibenzofuran-4-ylcarbazole
CID 58058989
9-(2-dibenzofuran-4-ylphenyl)-2,7-diphenyl-3,6-bis(2-phenylphenyl)carbazole
CID 166010977
9-dibenzofuran-4-yl-6-dibenzothiophen-4-yl-2-phenylcarbazole
CID 163656757
9-[7-(3-phenylnaphthalen-1-yl)dibenzofuran-4-yl]carbazole
CID 146335839
2-(9-dibenzofuran-4-ylcarbazol-3-yl)-9-fluoranthen-3-ylcarbazole
CID 70659172

Frequently Asked Questions

What is the IUPAC name of 9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole?
The IUPAC name of 9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole (CID 90348741) is 9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole.
What is the SMILES notation for 9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole?
The canonical SMILES for 9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole is c1ccc(-c2cc3c(cc2-c2ccc4c5ccccc5n(-c5cccc6c5oc5ccccc56)c4c2)c2ccccc2n3-c2cccc3c2oc2ccccc23)cc1.
What is the InChIKey of 9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole?
The InChIKey is BTNRJYBQUMRNLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H32N2O2/c1-2-14-33(15-3-1)43-32-50-44(36-17-5-9-23-46(36)56(50)48-25-13-21-41-39-19-7-11-27-52(39)58-54(41)48)31-42(43)34-28-29-37-35-16-4-8-22-45(35)55(49(37)30-34)47-24-12-20-40-38-18-6-10-26-51(38)57-53(40)47/h1-32H.
What are the key properties of 9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole?
9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole has a molecular weight of 740.86 g/mol, XLogP of 15.01, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole is sourced from PubChem (CID 90348741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).