N-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine

C120H108F12N4S4 — CID 162110441

IUPACN-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine
SMILESCc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc4c(C5=C(c6c(C)sc7cc(-c8ccc(N(c9ccc(C)cc9)c9ccc(C)cc9)cc8)ccc67)CCC5)c(C)sc4c3)cc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3sc(C)c(C4=C(c5c(C)sc(-c6ccc(N(c7ccc(C)cc7)c7ccc(C)cc7)cc6)c5C)CCC4)c3C)cc2)cc1.FF.FF.FF.FF.FF.FF
InChIInChI=1S/C63H54N2S2.C57H54N2S2.6F2/c1-40-10-24-50(25-11-40)64(51-26-12-41(2)13-27-51)54-32-18-46(19-33-54)48-22-36-58-60(38-48)66-44(5)62(58)56-8-7-9-57(56)63-45(6)67-61-39-49(23-37-59(61)63)47-20-34-55(35-21-47)65(52-28-14-42(3)15-29-52)53-30-16-43(4)17-31-53;1-36-12-24-46(25-13-36)58(47-26-14-37(2)15-27-47)50-32-20-44(21-33-50)56-40(5)54(42(7)60-56)52-10-9-11-53(52)55-41(6)57(61-43(55)8)45-22-34-51(35-23-45)59(48-28-16-38(3)17-29-48)49-30-18-39(4)19-31-49;6*1-2/h10-39H,7-9H2,1-6H3;12-35H,9-11H2,1-8H3;;;;;;
InChIKeyZGBRXODVKVPEJL-UHFFFAOYSA-N
MW1962.46 g/mol
LogP42.02
Rot. Bonds20

About N-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine

N-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine (PubChem CID 162110441) has the molecular formula C120H108F12N4S4 and a molecular weight of 1962.46 g/mol. Its IUPAC name is N-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine.

Molecular Properties

Compound NameN-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine
PubChem CID162110441
Molecular FormulaC120H108F12N4S4
Molecular Weight1962.46 g/mol
Exact Mass1960.73
IUPAC NameN-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine
SMILESCc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc4c(C5=C(c6c(C)sc7cc(-c8ccc(N(c9ccc(C)cc9)c9ccc(C)cc9)cc8)ccc67)CCC5)c(C)sc4c3)cc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3sc(C)c(C4=C(c5c(C)sc(-c6ccc(N(c7ccc(C)cc7)c7ccc(C)cc7)cc6)c5C)CCC4)c3C)cc2)cc1.FF.FF.FF.FF.FF.FF
InChIInChI=1S/C63H54N2S2.C57H54N2S2.6F2/c1-40-10-24-50(25-11-40)64(51-26-12-41(2)13-27-51)54-32-18-46(19-33-54)48-22-36-58-60(38-48)66-44(5)62(58)56-8-7-9-57(56)63-45(6)67-61-39-49(23-37-59(61)63)47-20-34-55(35-21-47)65(52-28-14-42(3)15-29-52)53-30-16-43(4)17-31-53;1-36-12-24-46(25-13-36)58(47-26-14-37(2)15-27-47)50-32-20-44(21-33-50)56-40(5)54(42(7)60-56)52-10-9-11-53(52)55-41(6)57(61-43(55)8)45-22-34-51(35-23-45)59(48-28-16-38(3)17-29-48)49-30-18-39(4)19-31-49;6*1-2/h10-39H,7-9H2,1-6H3;12-35H,9-11H2,1-8H3;;;;;;
InChIKeyZGBRXODVKVPEJL-UHFFFAOYSA-N
XLogP42.02
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds20
Heavy Atoms140
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001962.46
LogP ≤ 542.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze N-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine with MolForge

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Related Compounds

N-[4-[2-[4-[2-[2,4-dimethyl-5-[2-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]ethenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]ethenyl]phenyl]-4-methyl-N-(4-methylphenyl)aniline
CID 73458343
4-[5-methyl-4-[2-[2-methyl-5-[4-(N-phenylanilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]thiophen-2-yl]-N,N-diphenylaniline
CID 132501286
4-methyl-N-[4-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]phenyl]-N-(4-methylphenyl)aniline
CID 159454269
N,4-diphenyl-N-[4-(7-phenyldibenzothiophen-3-yl)phenyl]aniline
CID 118186820
N-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]-4-methyl-N-[4-[4-(4-methylphenyl)phenyl]phenyl]aniline
CID 58251007
6-(9,10-diphenylanthracen-2-yl)-2,3-bis(4-methylphenyl)-1-benzothiophene
CID 59012338
4-(2,3-dinaphthalen-2-yl-1-benzothiophen-6-yl)-N,N-diphenylaniline
CID 118459294
4-[4-[2-[5-[4-(diethylamino)phenyl]-2-methylthiophen-3-yl]cyclopenten-1-yl]-5-methylthiophen-2-yl]-N,N-diethylaniline
CID 101390044
4-(4-methylphenyl)-N-[4-(4-methylphenyl)phenyl]-N-[4-(2-phenyl-1H-[1]benzothiolo[3,2-e]indol-8-yl)phenyl]aniline
CID 170266204
N-[4-(2,3-dinaphthalen-1-yl-1-benzothiophen-6-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 118459286
1-[2-methyl-3-[2-(2-methyl-5-pyrrolidin-1-yl-1-benzothiophen-3-yl)cyclopenten-1-yl]-1-benzothiophen-5-yl]pyrrolidine
CID 122218444
4-methyl-N-(4-methylphenyl)-N-[4-[(E)-2-(4-triphenylen-2-ylphenyl)ethenyl]phenyl]aniline
CID 89314584

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine?
The IUPAC name of N-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine (CID 162110441) is N-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine.
What is the SMILES notation for N-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine?
The canonical SMILES for N-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine is Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc4c(C5=C(c6c(C)sc7cc(-c8ccc(N(c9ccc(C)cc9)c9ccc(C)cc9)cc8)ccc67)CCC5)c(C)sc4c3)cc2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3sc(C)c(C4=C(c5c(C)sc(-c6ccc(N(c7ccc(C)cc7)c7ccc(C)cc7)cc6)c5C)CCC4)c3C)cc2)cc1.FF.FF.FF.FF.FF.FF.
What is the InChIKey of N-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine?
The InChIKey is ZGBRXODVKVPEJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H54N2S2.C57H54N2S2.6F2/c1-40-10-24-50(25-11-40)64(51-26-12-41(2)13-27-51)54-32-18-46(19-33-54)48-22-36-58-60(38-48)66-44(5)62(58)56-8-7-9-57(56)63-45(6)67-61-39-49(23-37-59(61)63)47-20-34-55(35-21-47)65(52-28-14-42(3)15-29-52)53-30-16-43(4)17-31-53;1-36-12-24-46(25-13-36)58(47-26-14-37(2)15-27-47)50-32-20-44(21-33-50)56-40(5)54(42(7)60-56)52-10-9-11-53(52)55-41(6)57(61-43(55)8)45-22-34-51(35-23-45)59(48-28-16-38(3)17-29-48)49-30-18-39(4)19-31-49;6*1-2/h10-39H,7-9H2,1-6H3;12-35H,9-11H2,1-8H3;;;;;;.
What are the key properties of N-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine?
N-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine has a molecular weight of 1962.46 g/mol, XLogP of 42.02, 20 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-[2-[2,4-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]thiophen-3-yl]cyclopenten-1-yl]-3,5-dimethylthiophen-2-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-methyl-N-[4-[2-methyl-3-[2-[2-methyl-6-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1-benzothiophen-3-yl]cyclopenten-1-yl]-1-benzothiophen-6-yl]phenyl]-N-(4-methylphenyl)aniline;molecular fluorine is sourced from PubChem (CID 162110441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).