4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline

C56H38N2O — CID 118150060

IUPAC4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(-n5c6ccccc6c6oc7c(-c8ccccc8)cccc7c65)cc4)cc3)cc2)cc1
InChIInChI=1S/C56H38N2O/c1-4-13-39(14-5-1)41-23-31-46(32-24-41)57(47-33-25-42(26-34-47)40-15-6-2-7-16-40)48-35-27-43(28-36-48)44-29-37-49(38-30-44)58-53-22-11-10-19-51(53)56-54(58)52-21-12-20-50(55(52)59-56)45-17-8-3-9-18-45/h1-38H
InChIKeyBNWQGXNUNCLVGZ-UHFFFAOYSA-N
MW754.93 g/mol
LogP15.67
Rot. Bonds8

About 4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline

4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline (PubChem CID 118150060) has the molecular formula C56H38N2O and a molecular weight of 754.93 g/mol. Its IUPAC name is 4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline.

Molecular Properties

Compound Name4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
PubChem CID118150060
Molecular FormulaC56H38N2O
Molecular Weight754.93 g/mol
Exact Mass754.30
IUPAC Name4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(-n5c6ccccc6c6oc7c(-c8ccccc8)cccc7c65)cc4)cc3)cc2)cc1
InChIInChI=1S/C56H38N2O/c1-4-13-39(14-5-1)41-23-31-46(32-24-41)57(47-33-25-42(26-34-47)40-15-6-2-7-16-40)48-35-27-43(28-36-48)44-29-37-49(38-30-44)58-53-22-11-10-19-51(53)56-54(58)52-21-12-20-50(55(52)59-56)45-17-8-3-9-18-45/h1-38H
InChIKeyBNWQGXNUNCLVGZ-UHFFFAOYSA-N
XLogP15.67
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500754.93
LogP ≤ 515.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline with MolForge

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Related Compounds

4-phenyl-N-[4-(10-phenyl-[1]benzofuro[3,2-b]indol-6-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-(10-phenyl-[1]benzofuro[3,2-b]indol-6-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 158182642
N-[4-[4-(3,6-diphenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 118150067
N-(4-carbazol-9-ylphenyl)-4-naphthalen-1-yl-N-[4-(10-phenyl-[1]benzofuro[3,2-b]indol-6-yl)phenyl]aniline;N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(10-phenyl-[1]benzofuro[3,2-b]indol-6-yl)phenyl]aniline
CID 159625965
N-(4-naphthalen-1-ylphenyl)-N-[4-(10-phenyl-[1]benzofuro[3,2-b]indol-6-yl)phenyl]dibenzofuran-3-amine;N-[4-(10-phenyl-[1]benzofuro[3,2-b]indol-6-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 162093583
N-[4-[6-(3-carbazol-9-ylphenyl)dibenzofuran-4-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 90125897
4-[4-(N-(4-carbazol-9-ylphenyl)-4-dibenzofuran-4-ylanilino)phenyl]-N,N-diphenylaniline
CID 58510633
N,N-diphenyl-3-[4-(18-phenyl-15-oxa-12,18-diazaheptacyclo[14.11.0.02,14.05,13.06,11.017,25.019,24]heptacosa-1(16),2(14),3,5(13),6,8,10,17(25),19,21,23,26-dodecaen-12-yl)phenyl]aniline
CID 121286448
N-(4-carbazol-9-ylphenyl)-4-(6-phenyldibenzofuran-2-yl)-N-[4-(2-phenylphenyl)phenyl]aniline
CID 168804257
N-(4-bromophenyl)-4-phenyl-N-(4-phenylphenyl)aniline;methane;4-phenyl-N-[4-(1-phenylcarbazol-9-yl)phenyl]-N-(4-phenylphenyl)aniline
CID 158576235
N,N-bis(4-carbazol-9-ylphenyl)-4-dibenzofuran-4-ylaniline
CID 58510642
N-[4-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 90207163
N,N-diphenyl-4-[6-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]aniline
CID 90125795

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline?
The IUPAC name of 4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline (CID 118150060) is 4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline.
What is the SMILES notation for 4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline?
The canonical SMILES for 4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline is c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(-n5c6ccccc6c6oc7c(-c8ccccc8)cccc7c65)cc4)cc3)cc2)cc1.
What is the InChIKey of 4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline?
The InChIKey is BNWQGXNUNCLVGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H38N2O/c1-4-13-39(14-5-1)41-23-31-46(32-24-41)57(47-33-25-42(26-34-47)40-15-6-2-7-16-40)48-35-27-43(28-36-48)44-29-37-49(38-30-44)58-53-22-11-10-19-51(53)56-54(58)52-21-12-20-50(55(52)59-56)45-17-8-3-9-18-45/h1-38H.
What are the key properties of 4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline?
4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline has a molecular weight of 754.93 g/mol, XLogP of 15.67, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-[4-[4-(6-phenyl-[1]benzofuro[3,2-b]indol-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline is sourced from PubChem (CID 118150060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).