4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline

C188H115N3O9 — CID 167662502

IUPAC4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline
SMILESc1cc(-c2ccc(N(c3ccc(-c4cccc5oc6ccccc6c45)cc3)c3ccc(-c4cccc5oc6ccccc6c45)cc3)cc2)cc(-c2ccc3c(c2)oc2ccccc23)c1.c1ccc2c(c1)oc1cc(-c3ccc(-c4ccc(N(c5ccc(-c6cccc7oc8ccccc8c67)cc5)c5ccc(-c6cccc7oc8ccccc8c67)cc5)cc4)c4ccccc34)ccc12.c1ccc2c(c1)oc1ccc(-c3ccc4cc(-c5ccc(N(c6ccc(-c7cccc8oc9ccccc9c78)cc6)c6ccc(-c7cccc8oc9ccccc9c78)cc6)cc5)ccc4c3)cc12
InChIInChI=1S/2C64H39NO3.C60H37NO3/c1-4-14-57-53(9-1)56-39-47(29-36-60(56)66-57)46-22-21-44-37-43(19-20-45(44)38-46)40-23-30-48(31-24-40)65(49-32-25-41(26-33-49)51-12-7-17-61-63(51)54-10-2-5-15-58(54)67-61)50-34-27-42(28-35-50)52-13-8-18-62-64(52)55-11-3-6-16-59(55)68-62;1-2-12-52-48(43-29-36-54-53-13-3-6-18-57(53)68-62(54)39-43)38-37-47(51(52)11-1)40-23-30-44(31-24-40)65(45-32-25-41(26-33-45)49-16-9-21-60-63(49)55-14-4-7-19-58(55)66-60)46-34-27-42(28-35-46)50-17-10-22-61-64(50)56-15-5-8-20-59(56)67-61;1-4-17-53-49(12-1)50-35-28-43(37-58(50)64-53)42-11-7-10-41(36-42)38-22-29-44(30-23-38)61(45-31-24-39(25-32-45)47-15-8-20-56-59(47)51-13-2-5-18-54(51)62-56)46-33-26-40(27-34-46)48-16-9-21-57-60(48)52-14-3-6-19-55(52)63-57/h2*1-39H;1-37H
InChIKeySDMNLXHUYWJFFZ-UHFFFAOYSA-N
MW2560.00 g/mol
LogP54.87
Rot. Bonds21

About 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline

4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline (PubChem CID 167662502) has the molecular formula C188H115N3O9 and a molecular weight of 2560.00 g/mol. Its IUPAC name is 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline.

Molecular Properties

Compound Name4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline
PubChem CID167662502
Molecular FormulaC188H115N3O9
Molecular Weight2560.00 g/mol
Exact Mass2557.86
IUPAC Name4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline
SMILESc1cc(-c2ccc(N(c3ccc(-c4cccc5oc6ccccc6c45)cc3)c3ccc(-c4cccc5oc6ccccc6c45)cc3)cc2)cc(-c2ccc3c(c2)oc2ccccc23)c1.c1ccc2c(c1)oc1cc(-c3ccc(-c4ccc(N(c5ccc(-c6cccc7oc8ccccc8c67)cc5)c5ccc(-c6cccc7oc8ccccc8c67)cc5)cc4)c4ccccc34)ccc12.c1ccc2c(c1)oc1ccc(-c3ccc4cc(-c5ccc(N(c6ccc(-c7cccc8oc9ccccc9c78)cc6)c6ccc(-c7cccc8oc9ccccc9c78)cc6)cc5)ccc4c3)cc12
InChIInChI=1S/2C64H39NO3.C60H37NO3/c1-4-14-57-53(9-1)56-39-47(29-36-60(56)66-57)46-22-21-44-37-43(19-20-45(44)38-46)40-23-30-48(31-24-40)65(49-32-25-41(26-33-49)51-12-7-17-61-63(51)54-10-2-5-15-58(54)67-61)50-34-27-42(28-35-50)52-13-8-18-62-64(52)55-11-3-6-16-59(55)68-62;1-2-12-52-48(43-29-36-54-53-13-3-6-18-57(53)68-62(54)39-43)38-37-47(51(52)11-1)40-23-30-44(31-24-40)65(45-32-25-41(26-33-45)49-16-9-21-60-63(49)55-14-4-7-19-58(55)66-60)46-34-27-42(28-35-46)50-17-10-22-61-64(50)56-15-5-8-20-59(56)67-61;1-4-17-53-49(12-1)50-35-28-43(37-58(50)64-53)42-11-7-10-41(36-42)38-22-29-44(30-23-38)61(45-31-24-39(25-32-45)47-15-8-20-56-59(47)51-13-2-5-18-54(51)62-56)46-33-26-40(27-34-46)48-16-9-21-57-60(48)52-14-3-6-19-55(52)63-57/h2*1-39H;1-37H
InChIKeySDMNLXHUYWJFFZ-UHFFFAOYSA-N
XLogP54.87
TPSA127.98 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds21
Heavy Atoms200
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002560.00
LogP ≤ 554.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline with MolForge

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Related Compounds

N-(4-dibenzofuran-2-ylphenyl)-4-(3-naphthalen-2-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]aniline
CID 166566167
N-(4-dibenzofuran-1-ylphenyl)-N-[4-[3-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-4-phenylaniline
CID 166566303
N-(4-dibenzofuran-3-ylphenyl)-4-(3-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]aniline;N-(4-dibenzofuran-3-ylphenyl)-4-(4-naphthalen-1-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline
CID 159589004
N-(4-dibenzofuran-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenylaniline
CID 166565631
N-(4-dibenzofuran-2-ylphenyl)-N-[4-[3-(3-naphthalen-2-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine
CID 166566331
N-(4-dibenzofuran-3-ylphenyl)-N-[4-[3-(3-naphthalen-2-ylphenyl)phenyl]phenyl]dibenzofuran-2-amine
CID 166565962
4-dibenzofuran-1-yl-N-(4-dibenzofuran-1-ylphenyl)-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]aniline
CID 164835596
N-(3-dibenzofuran-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-N-(4-phenanthren-1-ylphenyl)aniline
CID 176810248
N-(3-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-3-(4-phenanthren-1-ylphenyl)aniline
CID 176810245
4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)aniline
CID 167330854
N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-4-[4-(3-naphthalen-2-ylphenyl)phenyl]aniline
CID 166566033
3-dibenzofuran-2-yl-N-(3-naphthalen-1-ylphenyl)-N-[4-(4-naphthalen-2-ylphenyl)phenyl]aniline
CID 170535241

Frequently Asked Questions

What is the IUPAC name of 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline?
The IUPAC name of 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline (CID 167662502) is 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline.
What is the SMILES notation for 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline?
The canonical SMILES for 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline is c1cc(-c2ccc(N(c3ccc(-c4cccc5oc6ccccc6c45)cc3)c3ccc(-c4cccc5oc6ccccc6c45)cc3)cc2)cc(-c2ccc3c(c2)oc2ccccc23)c1.c1ccc2c(c1)oc1cc(-c3ccc(-c4ccc(N(c5ccc(-c6cccc7oc8ccccc8c67)cc5)c5ccc(-c6cccc7oc8ccccc8c67)cc5)cc4)c4ccccc34)ccc12.c1ccc2c(c1)oc1ccc(-c3ccc4cc(-c5ccc(N(c6ccc(-c7cccc8oc9ccccc9c78)cc6)c6ccc(-c7cccc8oc9ccccc9c78)cc6)cc5)ccc4c3)cc12.
What is the InChIKey of 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline?
The InChIKey is SDMNLXHUYWJFFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C64H39NO3.C60H37NO3/c1-4-14-57-53(9-1)56-39-47(29-36-60(56)66-57)46-22-21-44-37-43(19-20-45(44)38-46)40-23-30-48(31-24-40)65(49-32-25-41(26-33-49)51-12-7-17-61-63(51)54-10-2-5-15-58(54)67-61)50-34-27-42(28-35-50)52-13-8-18-62-64(52)55-11-3-6-16-59(55)68-62;1-2-12-52-48(43-29-36-54-53-13-3-6-18-57(53)68-62(54)39-43)38-37-47(51(52)11-1)40-23-30-44(31-24-40)65(45-32-25-41(26-33-45)49-16-9-21-60-63(49)55-14-4-7-19-58(55)66-60)46-34-27-42(28-35-46)50-17-10-22-61-64(50)56-15-5-8-20-59(56)67-61;1-4-17-53-49(12-1)50-35-28-43(37-58(50)64-53)42-11-7-10-41(36-42)38-22-29-44(30-23-38)61(45-31-24-39(25-32-45)47-15-8-20-56-59(47)51-13-2-5-18-54(51)62-56)46-33-26-40(27-34-46)48-16-9-21-57-60(48)52-14-3-6-19-55(52)63-57/h2*1-39H;1-37H.
What are the key properties of 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline?
4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline has a molecular weight of 2560.00 g/mol, XLogP of 54.87, 21 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dibenzofuran-1-yl-N-[4-(4-dibenzofuran-3-ylnaphthalen-1-yl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)aniline;4-(6-dibenzofuran-2-ylnaphthalen-2-yl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline;4-(3-dibenzofuran-3-ylphenyl)-N,N-bis(4-dibenzofuran-1-ylphenyl)aniline is sourced from PubChem (CID 167662502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).