4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole

C61H36N4O2 — CID 142567912

IUPAC4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole
SMILESc1ccc(-c2nc(-c3ccc4c(c3)oc3ccccc34)nc(-n3c4cc5ccccc5cc4c4cccc(-c5cccc(-c6cccc(-c7cccc8c7oc7ccccc78)c6)c5)c43)n2)cc1
InChIInChI=1S/C61H36N4O2/c1-2-14-37(15-3-1)59-62-60(44-30-31-49-47-22-6-8-28-54(47)66-56(49)36-44)64-61(63-59)65-53-35-41-17-5-4-16-40(41)34-52(53)50-26-12-24-45(57(50)65)42-20-10-18-38(32-42)39-19-11-21-43(33-39)46-25-13-27-51-48-23-7-9-29-55(48)67-58(46)51/h1-36H
InChIKeyQOZFWLCPYINEID-UHFFFAOYSA-N
MW856.99 g/mol
LogP16.26
Rot. Bonds6

About 4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole

4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole (PubChem CID 142567912) has the molecular formula C61H36N4O2 and a molecular weight of 856.99 g/mol. Its IUPAC name is 4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole.

Molecular Properties

Compound Name4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole
PubChem CID142567912
Molecular FormulaC61H36N4O2
Molecular Weight856.99 g/mol
Exact Mass856.28
IUPAC Name4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole
SMILESc1ccc(-c2nc(-c3ccc4c(c3)oc3ccccc34)nc(-n3c4cc5ccccc5cc4c4cccc(-c5cccc(-c6cccc(-c7cccc8c7oc7ccccc78)c6)c5)c43)n2)cc1
InChIInChI=1S/C61H36N4O2/c1-2-14-37(15-3-1)59-62-60(44-30-31-49-47-22-6-8-28-54(47)66-56(49)36-44)64-61(63-59)65-53-35-41-17-5-4-16-40(41)34-52(53)50-26-12-24-45(57(50)65)42-20-10-18-38(32-42)39-19-11-21-43(33-39)46-25-13-27-51-48-23-7-9-29-55(48)67-58(46)51/h1-36H
InChIKeyQOZFWLCPYINEID-UHFFFAOYSA-N
XLogP16.26
TPSA69.88 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms67
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500856.99
LogP ≤ 516.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole 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

4-(3-dibenzofuran-4-ylphenyl)-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole;ethane
CID 142568556
4-dibenzofuran-4-yl-5-[4,6-di(dibenzofuran-3-yl)-1,3,5-triazin-2-yl]benzo[b]carbazole
CID 142570342
5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-4-naphtho[2,3-b][1]benzofuran-6-ylbenzo[b]carbazole
CID 142570024
4-dibenzofuran-2-yl-5-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]benzo[b]carbazole
CID 142571859
4-dibenzofuran-4-yl-5-[4-naphthalen-2-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]benzo[b]carbazole;methane
CID 142571046
6-dibenzofuran-4-yl-9-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-1-(3-dibenzothiophen-3-ylphenyl)carbazole
CID 163840544
12-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene
CID 166917707
1-(3-dibenzofuran-4-ylphenyl)-9-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole;ethane
CID 142568284
6-carbazol-9-yl-1-(3-dibenzofuran-4-ylphenyl)-9-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole;propane
CID 142568683
1-(3-dibenzofuran-4-ylphenyl)-9-[4-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;ethane
CID 142567985
5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-4-(9,9-dimethylfluoren-3-yl)benzo[b]carbazole
CID 142570978
5-[4,6-di(dibenzofuran-3-yl)-1,3,5-triazin-2-yl]-4-naphtho[2,1-b][1]benzofuran-10-ylbenzo[b]carbazole
CID 142572067

Frequently Asked Questions

What is the IUPAC name of 4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole?
The IUPAC name of 4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole (CID 142567912) is 4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole.
What is the SMILES notation for 4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole?
The canonical SMILES for 4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole is c1ccc(-c2nc(-c3ccc4c(c3)oc3ccccc34)nc(-n3c4cc5ccccc5cc4c4cccc(-c5cccc(-c6cccc(-c7cccc8c7oc7ccccc78)c6)c5)c43)n2)cc1.
What is the InChIKey of 4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole?
The InChIKey is QOZFWLCPYINEID-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H36N4O2/c1-2-14-37(15-3-1)59-62-60(44-30-31-49-47-22-6-8-28-54(47)66-56(49)36-44)64-61(63-59)65-53-35-41-17-5-4-16-40(41)34-52(53)50-26-12-24-45(57(50)65)42-20-10-18-38(32-42)39-19-11-21-43(33-39)46-25-13-27-51-48-23-7-9-29-55(48)67-58(46)51/h1-36H.
What are the key properties of 4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole?
4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole has a molecular weight of 856.99 g/mol, XLogP of 16.26, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-5-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)benzo[b]carbazole is sourced from PubChem (CID 142567912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).