N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline

C160H109N11O2 — CID 161463384

IUPACN-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc3)c3ccc(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc3)cc2)cc1.c1ccc(-n2c(-c3cccc(-c4ccc(N(c5ccc6c(c5)oc5ccccc56)c5ccc6c(c5)oc5ccccc56)cc4)c3)nc3ccccc32)cc1
InChIInChI=1S/C62H43N5.C49H31N3O2.C49H35N3/c1-4-16-44(17-5-1)45-30-36-54(37-31-45)65(55-38-32-46(33-39-55)48-18-14-20-50(42-48)61-63-57-26-10-12-28-59(57)66(61)52-22-6-2-7-23-52)56-40-34-47(35-41-56)49-19-15-21-51(43-49)62-64-58-27-11-13-29-60(58)67(62)53-24-8-3-9-25-53;1-2-13-35(14-3-1)52-44-18-7-6-17-43(44)50-49(52)34-12-10-11-33(29-34)32-21-23-36(24-22-32)51(37-25-27-41-39-15-4-8-19-45(39)53-47(41)30-37)38-26-28-42-40-16-5-9-20-46(40)54-48(42)31-38;1-4-13-36(14-5-1)38-23-29-44(30-24-38)51(45-31-25-39(26-32-45)37-15-6-2-7-16-37)46-33-27-40(28-34-46)41-17-12-18-42(35-41)49-50-47-21-10-11-22-48(47)52(49)43-19-8-3-9-20-43/h1-43H;1-31H;1-35H
InChIKeyWCCKQGOHXPKEFQ-UHFFFAOYSA-N
MW2217.71 g/mol
LogP42.96
Rot. Bonds24

About N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline

N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline (PubChem CID 161463384) has the molecular formula C160H109N11O2 and a molecular weight of 2217.71 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline.

Molecular Properties

Compound NameN-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
PubChem CID161463384
Molecular FormulaC160H109N11O2
Molecular Weight2217.71 g/mol
Exact Mass2215.88
IUPAC NameN-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc3)c3ccc(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc3)cc2)cc1.c1ccc(-n2c(-c3cccc(-c4ccc(N(c5ccc6c(c5)oc5ccccc56)c5ccc6c(c5)oc5ccccc56)cc4)c3)nc3ccccc32)cc1
InChIInChI=1S/C62H43N5.C49H31N3O2.C49H35N3/c1-4-16-44(17-5-1)45-30-36-54(37-31-45)65(55-38-32-46(33-39-55)48-18-14-20-50(42-48)61-63-57-26-10-12-28-59(57)66(61)52-22-6-2-7-23-52)56-40-34-47(35-41-56)49-19-15-21-51(43-49)62-64-58-27-11-13-29-60(58)67(62)53-24-8-3-9-25-53;1-2-13-35(14-3-1)52-44-18-7-6-17-43(44)50-49(52)34-12-10-11-33(29-34)32-21-23-36(24-22-32)51(37-25-27-41-39-15-4-8-19-45(39)53-47(41)30-37)38-26-28-42-40-16-5-9-20-46(40)54-48(42)31-38;1-4-13-36(14-5-1)38-23-29-44(30-24-38)51(45-31-25-39(26-32-45)37-15-6-2-7-16-37)46-33-27-40(28-34-46)41-17-12-18-42(35-41)49-50-47-21-10-11-22-48(47)52(49)43-19-8-3-9-20-43/h1-43H;1-31H;1-35H
InChIKeyWCCKQGOHXPKEFQ-UHFFFAOYSA-N
XLogP42.96
TPSA107.28 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds24
Heavy Atoms173
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002217.71
LogP ≤ 542.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Analyze N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline?
The IUPAC name of N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline (CID 161463384) is N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline.
What is the SMILES notation for N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline?
The canonical SMILES for N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline is c1ccc(-c2ccc(N(c3ccc(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc3)c3ccc(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc(-c5nc6ccccc6n5-c5ccccc5)c4)cc3)cc2)cc1.c1ccc(-n2c(-c3cccc(-c4ccc(N(c5ccc6c(c5)oc5ccccc56)c5ccc6c(c5)oc5ccccc56)cc4)c3)nc3ccccc32)cc1.
What is the InChIKey of N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline?
The InChIKey is WCCKQGOHXPKEFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H43N5.C49H31N3O2.C49H35N3/c1-4-16-44(17-5-1)45-30-36-54(37-31-45)65(55-38-32-46(33-39-55)48-18-14-20-50(42-48)61-63-57-26-10-12-28-59(57)66(61)52-22-6-2-7-23-52)56-40-34-47(35-41-56)49-19-15-21-51(43-49)62-64-58-27-11-13-29-60(58)67(62)53-24-8-3-9-25-53;1-2-13-35(14-3-1)52-44-18-7-6-17-43(44)50-49(52)34-12-10-11-33(29-34)32-21-23-36(24-22-32)51(37-25-27-41-39-15-4-8-19-45(39)53-47(41)30-37)38-26-28-42-40-16-5-9-20-46(40)54-48(42)31-38;1-4-13-36(14-5-1)38-23-29-44(30-24-38)51(45-31-25-39(26-32-45)37-15-6-2-7-16-37)46-33-27-40(28-34-46)41-17-12-18-42(35-41)49-50-47-21-10-11-22-48(47)52(49)43-19-8-3-9-20-43/h1-43H;1-31H;1-35H.
What are the key properties of N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline?
N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline has a molecular weight of 2217.71 g/mol, XLogP of 42.96, 24 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline is sourced from PubChem (CID 161463384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).