5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine

C54H38N2O — CID 118004686

IUPAC5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine
SMILESc1ccc(-c2ccccc2-c2c(-c3cccc4c3oc3ccccc34)cc(N(c3ccccc3)c3ccccc3)cc2N(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C54H38N2O/c1-6-21-39(22-7-1)45-31-16-17-33-47(45)53-50(49-35-20-34-48-46-32-18-19-36-52(46)57-54(48)49)37-44(55(40-23-8-2-9-24-40)41-25-10-3-11-26-41)38-51(53)56(42-27-12-4-13-28-42)43-29-14-5-15-30-43/h1-38H
InChIKeyDRLJSEJEOIAZGD-UHFFFAOYSA-N
MW730.91 g/mol
LogP15.53
Rot. Bonds9

About 5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine

5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine (PubChem CID 118004686) has the molecular formula C54H38N2O and a molecular weight of 730.91 g/mol. Its IUPAC name is 5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine.

Molecular Properties

Compound Name5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine
PubChem CID118004686
Molecular FormulaC54H38N2O
Molecular Weight730.91 g/mol
Exact Mass730.30
IUPAC Name5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine
SMILESc1ccc(-c2ccccc2-c2c(-c3cccc4c3oc3ccccc34)cc(N(c3ccccc3)c3ccccc3)cc2N(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C54H38N2O/c1-6-21-39(22-7-1)45-31-16-17-33-47(45)53-50(49-35-20-34-48-46-32-18-19-36-52(46)57-54(48)49)37-44(55(40-23-8-2-9-24-40)41-25-10-3-11-26-41)38-51(53)56(42-27-12-4-13-28-42)43-29-14-5-15-30-43/h1-38H
InChIKeyDRLJSEJEOIAZGD-UHFFFAOYSA-N
XLogP15.53
TPSA19.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500730.91
LogP ≤ 515.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine 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

N-(3-dibenzofuran-4-ylphenyl)-N,3-diphenyl-2-(2-phenylphenyl)aniline
CID 168789688
N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N,4-diphenylaniline
CID 154961695
N-(4-dibenzofuran-4-ylphenyl)-3-phenyl-2-(2-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 168788600
5-N-(4-dibenzofuran-4-ylphenyl)-1-N,3-N-dinaphthalen-1-yl-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine
CID 118604838
1-N,4-N-bis(4-dibenzofuran-4-ylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine
CID 59022075
4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-phenylaniline
CID 59022085
N-(4-dibenzofuran-4-ylphenyl)-N-[4-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-1-amine
CID 168789686
1-N,4-N-bis(4-dibenzofuran-4-ylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4-N-(4-dibenzofuran-4-ylphenyl)-1-N-[4-[4-(N-[4-(N-(4-dibenzofuran-4-ylphenyl)anilino)phenyl]anilino)phenyl]phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;N-(4-dibenzofuran-4-ylphenyl)-4-[4-[4-(N-(4-dibenzofuran-4-ylphenyl)anilino)phenyl]phenyl]-N-phenylaniline;4-[4-[N-(4-dibenzofuran-4-ylphenyl)-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline
CID 167553634
N-[4-(2-phenylphenyl)phenyl]-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-4-amine
CID 164744348
N-(2-dibenzofuran-4-ylphenyl)-N-(4-dibenzofuran-3-ylphenyl)-3-phenyl-2-(2-phenylphenyl)aniline
CID 168791089
N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 157079303
N-(4-dibenzofuran-4-ylphenyl)-1-(2-phenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine
CID 177281522

Frequently Asked Questions

What is the IUPAC name of 5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine?
The IUPAC name of 5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine (CID 118004686) is 5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine.
What is the SMILES notation for 5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine?
The canonical SMILES for 5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine is c1ccc(-c2ccccc2-c2c(-c3cccc4c3oc3ccccc34)cc(N(c3ccccc3)c3ccccc3)cc2N(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine?
The InChIKey is DRLJSEJEOIAZGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H38N2O/c1-6-21-39(22-7-1)45-31-16-17-33-47(45)53-50(49-35-20-34-48-46-32-18-19-36-52(46)57-54(48)49)37-44(55(40-23-8-2-9-24-40)41-25-10-3-11-26-41)38-51(53)56(42-27-12-4-13-28-42)43-29-14-5-15-30-43/h1-38H.
What are the key properties of 5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine?
5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine has a molecular weight of 730.91 g/mol, XLogP of 15.53, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-dibenzofuran-4-yl-1-N,1-N,3-N,3-N-tetraphenyl-4-(2-phenylphenyl)benzene-1,3-diamine is sourced from PubChem (CID 118004686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).