8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine

C160H103N3O3S3 — CID 161143692

IUPAC8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc5sc6ccc(-c7ccc8oc9ccccc9c8c7)cc6c5c4)c4cccc5ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3ccc4oc5ccc(-c6ccc7oc8ccccc8c7c6)cc5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3ccc4sc5ccc(-c6ccc7sc8ccccc8c7c6)cc5c4c3)cc2)cc1
InChIInChI=1S/C54H35NO2.C54H35NS2.C52H33NOS/c1-4-12-36(13-5-1)39-20-24-44(25-21-39)55(46-31-42(37-14-6-2-7-15-37)30-43(32-46)38-16-8-3-9-17-38)45-26-29-54-50(35-45)49-34-41(23-28-53(49)57-54)40-22-27-52-48(33-40)47-18-10-11-19-51(47)56-52;1-3-10-36(11-4-1)38-18-24-44(25-19-38)55(45-26-20-39(21-27-45)41-15-9-14-40(32-41)37-12-5-2-6-13-37)46-28-31-54-50(35-46)49-34-43(23-30-53(49)57-54)42-22-29-52-48(33-42)47-16-7-8-17-51(47)56-52;1-2-9-34(10-3-1)35-17-19-36(20-18-35)37-21-25-41(26-22-37)53(48-15-8-12-38-11-4-5-13-43(38)48)42-27-30-52-47(33-42)46-32-40(24-29-51(46)55-52)39-23-28-50-45(31-39)44-14-6-7-16-49(44)54-50/h2*1-35H;1-33H
InChIKeyUNTUYTGMIYPLBO-UHFFFAOYSA-N
MW2211.80 g/mol
LogP47.76
Rot. Bonds20

About 8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine

8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine (PubChem CID 161143692) has the molecular formula C160H103N3O3S3 and a molecular weight of 2211.80 g/mol. Its IUPAC name is 8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine.

Molecular Properties

Compound Name8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine
PubChem CID161143692
Molecular FormulaC160H103N3O3S3
Molecular Weight2211.80 g/mol
Exact Mass2209.72
IUPAC Name8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc5sc6ccc(-c7ccc8oc9ccccc9c8c7)cc6c5c4)c4cccc5ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3ccc4oc5ccc(-c6ccc7oc8ccccc8c7c6)cc5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3ccc4sc5ccc(-c6ccc7sc8ccccc8c7c6)cc5c4c3)cc2)cc1
InChIInChI=1S/C54H35NO2.C54H35NS2.C52H33NOS/c1-4-12-36(13-5-1)39-20-24-44(25-21-39)55(46-31-42(37-14-6-2-7-15-37)30-43(32-46)38-16-8-3-9-17-38)45-26-29-54-50(35-45)49-34-41(23-28-53(49)57-54)40-22-27-52-48(33-40)47-18-10-11-19-51(47)56-52;1-3-10-36(11-4-1)38-18-24-44(25-19-38)55(45-26-20-39(21-27-45)41-15-9-14-40(32-41)37-12-5-2-6-13-37)46-28-31-54-50(35-46)49-34-43(23-30-53(49)57-54)42-22-29-52-48(33-42)47-16-7-8-17-51(47)56-52;1-2-9-34(10-3-1)35-17-19-36(20-18-35)37-21-25-41(26-22-37)53(48-15-8-12-38-11-4-5-13-43(38)48)42-27-30-52-47(33-42)46-32-40(24-29-51(46)55-52)39-23-28-50-45(31-39)44-14-6-7-16-49(44)54-50/h2*1-35H;1-33H
InChIKeyUNTUYTGMIYPLBO-UHFFFAOYSA-N
XLogP47.76
TPSA49.14 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds20
Heavy Atoms169
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002211.80
LogP ≤ 547.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine 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

Frequently Asked Questions

What is the IUPAC name of 8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine?
The IUPAC name of 8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine (CID 161143692) is 8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine.
What is the SMILES notation for 8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine?
The canonical SMILES for 8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccc5sc6ccc(-c7ccc8oc9ccccc9c8c7)cc6c5c4)c4cccc5ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3ccc4oc5ccc(-c6ccc7oc8ccccc8c7c6)cc5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3ccc4sc5ccc(-c6ccc7sc8ccccc8c7c6)cc5c4c3)cc2)cc1.
What is the InChIKey of 8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine?
The InChIKey is UNTUYTGMIYPLBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H35NO2.C54H35NS2.C52H33NOS/c1-4-12-36(13-5-1)39-20-24-44(25-21-39)55(46-31-42(37-14-6-2-7-15-37)30-43(32-46)38-16-8-3-9-17-38)45-26-29-54-50(35-45)49-34-41(23-28-53(49)57-54)40-22-27-52-48(33-40)47-18-10-11-19-51(47)56-52;1-3-10-36(11-4-1)38-18-24-44(25-19-38)55(45-26-20-39(21-27-45)41-15-9-14-40(32-41)37-12-5-2-6-13-37)46-28-31-54-50(35-46)49-34-43(23-30-53(49)57-54)42-22-29-52-48(33-42)47-16-7-8-17-51(47)56-52;1-2-9-34(10-3-1)35-17-19-36(20-18-35)37-21-25-41(26-22-37)53(48-15-8-12-38-11-4-5-13-43(38)48)42-27-30-52-47(33-42)46-32-40(24-29-51(46)55-52)39-23-28-50-45(31-39)44-14-6-7-16-49(44)54-50/h2*1-35H;1-33H.
What are the key properties of 8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine?
8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine has a molecular weight of 2211.80 g/mol, XLogP of 47.76, 20 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine is sourced from PubChem (CID 161143692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).