N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine

C216H138N4O4S4 — CID 158542186

IUPACN-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine
SMILESc1ccc(-c2cc(-c3ccc4oc5ccccc5c4c3)cc(N(c3ccc(-c4cc5ccccc5c5ccccc45)cc3)c3cccc4c3sc3ccccc34)c2)cc1.c1ccc(-c2cc(-c3ccc4oc5ccccc5c4c3)cc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc4c3sc3ccccc34)c2)cc1.c1ccc(-c2cc(-c3ccc4oc5ccccc5c4c3)cc(N(c3ccc(-c4ccccc4-c4ccccc4)cc3)c3cccc4c3sc3ccccc34)c2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4cc(-c5ccccc5)cc(-c5ccc6oc7ccccc7c6c5)c4)c4cccc5c4sc4ccccc45)cc3)cc2)cc1
InChIInChI=1S/C56H35NOS.2C54H35NOS.C52H33NOS/c1-2-13-36(14-3-1)40-31-41(38-27-30-54-51(34-38)47-19-8-10-23-53(47)58-54)33-43(32-40)57(52-22-12-21-49-48-20-9-11-24-55(48)59-56(49)52)42-28-25-37(26-29-42)50-35-39-15-4-5-16-44(39)45-17-6-7-18-46(45)50;1-3-12-36(13-4-1)38-22-24-39(25-23-38)40-26-29-44(30-27-40)55(50-19-11-18-48-47-17-8-10-21-53(47)57-54(48)50)45-33-42(37-14-5-2-6-15-37)32-43(34-45)41-28-31-52-49(35-41)46-16-7-9-20-51(46)56-52;1-3-14-36(15-4-1)40-32-41(39-28-31-52-49(35-39)46-20-9-11-24-51(46)56-52)34-43(33-40)55(50-23-13-22-48-47-21-10-12-25-53(47)57-54(48)50)42-29-26-38(27-30-42)45-19-8-7-18-44(45)37-16-5-2-6-17-37;1-2-11-34(12-3-1)40-30-41(39-25-28-50-47(33-39)44-15-6-8-19-49(44)54-50)32-43(31-40)53(48-18-10-17-46-45-16-7-9-20-51(45)55-52(46)48)42-26-23-36(24-27-42)38-22-21-35-13-4-5-14-37(35)29-38/h1-35H;2*1-35H;1-33H
InChIKeyHOQUUDUWWCGFMS-UHFFFAOYSA-N
MW2981.77 g/mol
LogP64.49
Rot. Bonds26

About N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine

N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine (PubChem CID 158542186) has the molecular formula C216H138N4O4S4 and a molecular weight of 2981.77 g/mol. Its IUPAC name is N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine.

Molecular Properties

Compound NameN-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine
PubChem CID158542186
Molecular FormulaC216H138N4O4S4
Molecular Weight2981.77 g/mol
Exact Mass2978.96
IUPAC NameN-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine
SMILESc1ccc(-c2cc(-c3ccc4oc5ccccc5c4c3)cc(N(c3ccc(-c4cc5ccccc5c5ccccc45)cc3)c3cccc4c3sc3ccccc34)c2)cc1.c1ccc(-c2cc(-c3ccc4oc5ccccc5c4c3)cc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc4c3sc3ccccc34)c2)cc1.c1ccc(-c2cc(-c3ccc4oc5ccccc5c4c3)cc(N(c3ccc(-c4ccccc4-c4ccccc4)cc3)c3cccc4c3sc3ccccc34)c2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4cc(-c5ccccc5)cc(-c5ccc6oc7ccccc7c6c5)c4)c4cccc5c4sc4ccccc45)cc3)cc2)cc1
InChIInChI=1S/C56H35NOS.2C54H35NOS.C52H33NOS/c1-2-13-36(14-3-1)40-31-41(38-27-30-54-51(34-38)47-19-8-10-23-53(47)58-54)33-43(32-40)57(52-22-12-21-49-48-20-9-11-24-55(48)59-56(49)52)42-28-25-37(26-29-42)50-35-39-15-4-5-16-44(39)45-17-6-7-18-46(45)50;1-3-12-36(13-4-1)38-22-24-39(25-23-38)40-26-29-44(30-27-40)55(50-19-11-18-48-47-17-8-10-21-53(47)57-54(48)50)45-33-42(37-14-5-2-6-15-37)32-43(34-45)41-28-31-52-49(35-41)46-16-7-9-20-51(46)56-52;1-3-14-36(15-4-1)40-32-41(39-28-31-52-49(35-39)46-20-9-11-24-51(46)56-52)34-43(33-40)55(50-23-13-22-48-47-21-10-12-25-53(47)57-54(48)50)42-29-26-38(27-30-42)45-19-8-7-18-44(45)37-16-5-2-6-17-37;1-2-11-34(12-3-1)40-30-41(39-25-28-50-47(33-39)44-15-6-8-19-49(44)54-50)32-43(31-40)53(48-18-10-17-46-45-16-7-9-20-51(45)55-52(46)48)42-26-23-36(24-27-42)38-22-21-35-13-4-5-14-37(35)29-38/h1-35H;2*1-35H;1-33H
InChIKeyHOQUUDUWWCGFMS-UHFFFAOYSA-N
XLogP64.49
TPSA65.52 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds26
Heavy Atoms228
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002981.77
LogP ≤ 564.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine with MolForge

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Related Compounds

N-(3-dibenzothiophen-4-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzofuran-3-amine;N-(3-dibenzothiophen-4-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzofuran-3-amine;N-(3-dibenzothiophen-4-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine
CID 158454891
N-[4-(9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-3-amine;N-[4-(9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-yl)phenyl]-N-[4-(7-phenylnaphthalen-2-yl)phenyl]dibenzothiophen-4-amine;N-[4-(9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[4-(9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 165083837
N-dibenzothiophen-4-yl-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine;N-dibenzothiophen-4-yl-N-(4-naphthalen-2-ylphenyl)dibenzofuran-4-amine;N-dibenzothiophen-4-yl-N-(4-phenanthren-9-ylphenyl)dibenzofuran-4-amine;N-dibenzothiophen-4-yl-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 163970768
N-(3-dibenzothiophen-4-yl-4-phenylphenyl)-N-(4-naphthalen-1-ylphenyl)dibenzofuran-2-amine;N-(3-dibenzothiophen-4-yl-4-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzofuran-2-amine;N-(3-dibenzothiophen-4-yl-4-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzofuran-2-amine;N-(3-dibenzothiophen-4-yl-4-phenylphenyl)-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine;N-(3-dibenzothiophen-4-yl-4-phenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(3-dibenzothiophen-4-yl-4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzofuran-2-amine;N-(3-dibenzothiophen-4-yl-4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 158922916
N-[4-(9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-yl)phenyl]-N-[4-(7-phenylnaphthalen-2-yl)phenyl]dibenzothiophen-4-amine
CID 164974665
3-dibenzofuran-2-yl-N-(4-dibenzothiophen-4-ylphenyl)-N-[4-(4-naphthalen-2-ylphenyl)phenyl]aniline
CID 170535193
3-dibenzofuran-2-yl-N-(4-dibenzothiophen-4-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 170535112
N-dibenzothiophen-4-yl-N-(7-phenylphenanthren-2-yl)dibenzofuran-2-amine
CID 163425297
N-dibenzothiophen-4-yl-N-(5-naphthalen-2-yl-2-phenylphenyl)dibenzofuran-2-amine
CID 167236480
N-dibenzothiophen-4-yl-N-[3-(5-phenylnaphthalen-2-yl)phenyl]dibenzofuran-3-amine
CID 154605494
N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(5-phenanthren-9-yl-2-phenylphenyl)dibenzothiophen-4-amine
CID 167235379
4-dibenzofuran-2-yl-N-(4-dibenzothiophen-4-ylphenyl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-3,5-diphenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)naphthalen-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-(4-dibenzothiophen-2-ylphenyl)naphthalen-1-amine;bis(N-(4-dibenzofuran-4-ylphenyl)-N-(4-dibenzothiophen-2-ylphenyl)naphthalen-2-amine);N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-4-phenylaniline
CID 159591700

Frequently Asked Questions

What is the IUPAC name of N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine?
The IUPAC name of N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine (CID 158542186) is N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine.
What is the SMILES notation for N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine?
The canonical SMILES for N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine is c1ccc(-c2cc(-c3ccc4oc5ccccc5c4c3)cc(N(c3ccc(-c4cc5ccccc5c5ccccc45)cc3)c3cccc4c3sc3ccccc34)c2)cc1.c1ccc(-c2cc(-c3ccc4oc5ccccc5c4c3)cc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc4c3sc3ccccc34)c2)cc1.c1ccc(-c2cc(-c3ccc4oc5ccccc5c4c3)cc(N(c3ccc(-c4ccccc4-c4ccccc4)cc3)c3cccc4c3sc3ccccc34)c2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4cc(-c5ccccc5)cc(-c5ccc6oc7ccccc7c6c5)c4)c4cccc5c4sc4ccccc45)cc3)cc2)cc1.
What is the InChIKey of N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine?
The InChIKey is HOQUUDUWWCGFMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H35NOS.2C54H35NOS.C52H33NOS/c1-2-13-36(14-3-1)40-31-41(38-27-30-54-51(34-38)47-19-8-10-23-53(47)58-54)33-43(32-40)57(52-22-12-21-49-48-20-9-11-24-55(48)59-56(49)52)42-28-25-37(26-29-42)50-35-39-15-4-5-16-44(39)45-17-6-7-18-46(45)50;1-3-12-36(13-4-1)38-22-24-39(25-23-38)40-26-29-44(30-27-40)55(50-19-11-18-48-47-17-8-10-21-53(47)57-54(48)50)45-33-42(37-14-5-2-6-15-37)32-43(34-45)41-28-31-52-49(35-41)46-16-7-9-20-51(46)56-52;1-3-14-36(15-4-1)40-32-41(39-28-31-52-49(35-39)46-20-9-11-24-51(46)56-52)34-43(33-40)55(50-23-13-22-48-47-21-10-12-25-53(47)57-54(48)50)42-29-26-38(27-30-42)45-19-8-7-18-44(45)37-16-5-2-6-17-37;1-2-11-34(12-3-1)40-30-41(39-25-28-50-47(33-39)44-15-6-8-19-49(44)54-50)32-43(31-40)53(48-18-10-17-46-45-16-7-9-20-51(45)55-52(46)48)42-26-23-36(24-27-42)38-22-21-35-13-4-5-14-37(35)29-38/h1-35H;2*1-35H;1-33H.
What are the key properties of N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine?
N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine has a molecular weight of 2981.77 g/mol, XLogP of 64.49, 26 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]dibenzothiophen-4-amine;N-(3-dibenzofuran-2-yl-5-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine is sourced from PubChem (CID 158542186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).