9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole

C48H30N2O — CID 155120118

IUPAC9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole
SMILESc1ccc(-c2ccc3oc4ccccc4c3c2)c(-c2cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c2)c1
InChIInChI=1S/C48H30N2O/c1-2-14-36(35(13-1)31-25-26-48-42(29-31)41-19-7-12-24-47(41)51-48)32-27-33(49-43-20-8-3-15-37(43)38-16-4-9-21-44(38)49)30-34(28-32)50-45-22-10-5-17-39(45)40-18-6-11-23-46(40)50/h1-30H
InChIKeyQXCZPXHUXSSLQK-UHFFFAOYSA-N
MW650.78 g/mol
LogP13.11
Rot. Bonds4

About 9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole

9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole (PubChem CID 155120118) has the molecular formula C48H30N2O and a molecular weight of 650.78 g/mol. Its IUPAC name is 9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole.

Molecular Properties

Compound Name9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole
PubChem CID155120118
Molecular FormulaC48H30N2O
Molecular Weight650.78 g/mol
Exact Mass650.24
IUPAC Name9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole
SMILESc1ccc(-c2ccc3oc4ccccc4c3c2)c(-c2cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c2)c1
InChIInChI=1S/C48H30N2O/c1-2-14-36(35(13-1)31-25-26-48-42(29-31)41-19-7-12-24-47(41)51-48)32-27-33(49-43-20-8-3-15-37(43)38-16-4-9-21-44(38)49)30-34(28-32)50-45-22-10-5-17-39(45)40-18-6-11-23-46(40)50/h1-30H
InChIKeyQXCZPXHUXSSLQK-UHFFFAOYSA-N
XLogP13.11
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms51
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500650.78
LogP ≤ 513.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole?
The IUPAC name of 9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole (CID 155120118) is 9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole.
What is the SMILES notation for 9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole?
The canonical SMILES for 9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole is c1ccc(-c2ccc3oc4ccccc4c3c2)c(-c2cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c2)c1.
What is the InChIKey of 9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole?
The InChIKey is QXCZPXHUXSSLQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30N2O/c1-2-14-36(35(13-1)31-25-26-48-42(29-31)41-19-7-12-24-47(41)51-48)32-27-33(49-43-20-8-3-15-37(43)38-16-4-9-21-44(38)49)30-34(28-32)50-45-22-10-5-17-39(45)40-18-6-11-23-46(40)50/h1-30H.
What are the key properties of 9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole?
9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole has a molecular weight of 650.78 g/mol, XLogP of 13.11, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-carbazol-9-yl-5-(2-dibenzofuran-2-ylphenyl)phenyl]carbazole is sourced from PubChem (CID 155120118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).