3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole

C47H30N2O — CID 163917513

IUPAC3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c(c3)oc3cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c34)c2)cc1
InChIInChI=1S/C47H30N2O/c1-4-13-31(14-5-1)35-28-41(32-15-6-2-7-16-32)48-42(29-35)34-23-25-39-46(30-34)50-45-22-12-20-37(47(39)45)33-24-26-44-40(27-33)38-19-10-11-21-43(38)49(44)36-17-8-3-9-18-36/h1-30H
InChIKeyQXNRRFVRTOPYCT-UHFFFAOYSA-N
MW638.77 g/mol
LogP12.75
Rot. Bonds5

About 3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole

3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole (PubChem CID 163917513) has the molecular formula C47H30N2O and a molecular weight of 638.77 g/mol. Its IUPAC name is 3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole
PubChem CID163917513
Molecular FormulaC47H30N2O
Molecular Weight638.77 g/mol
Exact Mass638.24
IUPAC Name3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c(c3)oc3cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c34)c2)cc1
InChIInChI=1S/C47H30N2O/c1-4-13-31(14-5-1)35-28-41(32-15-6-2-7-16-32)48-42(29-35)34-23-25-39-46(30-34)50-45-22-12-20-37(47(39)45)33-24-26-44-40(27-33)38-19-10-11-21-43(38)49(44)36-17-8-3-9-18-36/h1-30H
InChIKeyQXNRRFVRTOPYCT-UHFFFAOYSA-N
XLogP12.75
TPSA30.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500638.77
LogP ≤ 512.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-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

2-[1-[9-(2-dibenzofuran-3-yl-6-phenyl-4-pyridinyl)dibenzofuran-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole
CID 168768283
3-[9-(4-dibenzofuran-3-yl-6-phenyl-2-pyridinyl)dibenzofuran-2-yl]-9-(3-phenylphenyl)carbazole
CID 168768511
3-[9-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-3-yl]carbazol-3-yl]-9-phenylcarbazole
CID 146334319
2-[9-(6-dibenzofuran-3-yl-4-phenyl-2-pyridinyl)dibenzofuran-2-yl]-9-phenylcarbazole
CID 168768728
2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole
CID 159916327
3-[9-(6-dibenzofuran-3-yl-2-phenylpyrimidin-4-yl)dibenzofuran-3-yl]-6,9-diphenylcarbazole
CID 168768203
3-[9-(6-dibenzofuran-3-yl-4-phenyl-2-pyridinyl)dibenzothiophen-2-yl]-9-phenylcarbazole
CID 168768114
9-(4-dibenzofuran-4-ylphenyl)-3-[9-(4-dibenzofuran-3-yl-6-phenyl-2-pyridinyl)dibenzofuran-2-yl]carbazole
CID 168768588
3-[1-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-9-(4-phenylphenyl)carbazole
CID 158968251
9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3-(3-phenylphenyl)carbazole
CID 167329299
9-phenyl-3-[4-[9-[4-phenyl-6-(9-phenyldibenzofuran-3-yl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]phenyl]carbazole
CID 168767881
3-[9-[9-[4-dibenzofuran-3-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 168767734

Frequently Asked Questions

What is the IUPAC name of 3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole?
The IUPAC name of 3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole (CID 163917513) is 3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole.
What is the SMILES notation for 3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole?
The canonical SMILES for 3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole is c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c(c3)oc3cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c34)c2)cc1.
What is the InChIKey of 3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole?
The InChIKey is QXNRRFVRTOPYCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H30N2O/c1-4-13-31(14-5-1)35-28-41(32-15-6-2-7-16-32)48-42(29-35)34-23-25-39-46(30-34)50-45-22-12-20-37(47(39)45)33-24-26-44-40(27-33)38-19-10-11-21-43(38)49(44)36-17-8-3-9-18-36/h1-30H.
What are the key properties of 3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole?
3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole has a molecular weight of 638.77 g/mol, XLogP of 12.75, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[7-(4,6-diphenyl-2-pyridinyl)dibenzofuran-1-yl]-9-phenylcarbazole is sourced from PubChem (CID 163917513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).