4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline

C122H92F4N2O2 — CID 166686325

IUPAC4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline
SMILESC=Cc1ccc(Oc2ccc(C3(c4ccc(C(C)(C)C)cc4)c4ccccc4-c4ccc(-c5ccc(N(c6ccc(-c7ccc(N(c8ccc(-c9ccc%10c(c9)C(c9ccc(Oc%11ccc(C=C)cc%11)cc9)(c9ccc(C(C)(C)C)cc9)c9ccccc9-%10)cc8)c8ccc(-c9ccc(F)cc9F)cc8)cc7)cc6)c6ccc(-c7ccc(F)cc7F)cc6)cc5)cc43)cc2)cc1
InChIInChI=1S/C122H92F4N2O2/c1-9-79-19-63-103(64-20-79)129-105-67-45-93(46-68-105)121(91-41-37-89(38-42-91)119(3,4)5)113-17-13-11-15-109(113)111-71-35-87(75-115(111)121)83-27-55-99(56-28-83)127(101-59-31-85(32-60-101)107-73-49-95(123)77-117(107)125)97-51-23-81(24-52-97)82-25-53-98(54-26-82)128(102-61-33-86(34-62-102)108-74-50-96(124)78-118(108)126)100-57-29-84(30-58-100)88-36-72-112-110-16-12-14-18-114(110)122(116(112)76-88,92-43-39-90(40-44-92)120(6,7)8)94-47-69-106(70-48-94)130-104-65-21-80(10-2)22-66-104/h9-78H,1-2H2,3-8H3
InChIKeyPFLWNMROTPKRST-UHFFFAOYSA-N
MW1694.08 g/mol
LogP33.71
Rot. Bonds21

About 4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline

4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline (PubChem CID 166686325) has the molecular formula C122H92F4N2O2 and a molecular weight of 1694.08 g/mol. Its IUPAC name is 4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline.

Molecular Properties

Compound Name4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline
PubChem CID166686325
Molecular FormulaC122H92F4N2O2
Molecular Weight1694.08 g/mol
Exact Mass1692.71
IUPAC Name4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline
SMILESC=Cc1ccc(Oc2ccc(C3(c4ccc(C(C)(C)C)cc4)c4ccccc4-c4ccc(-c5ccc(N(c6ccc(-c7ccc(N(c8ccc(-c9ccc%10c(c9)C(c9ccc(Oc%11ccc(C=C)cc%11)cc9)(c9ccc(C(C)(C)C)cc9)c9ccccc9-%10)cc8)c8ccc(-c9ccc(F)cc9F)cc8)cc7)cc6)c6ccc(-c7ccc(F)cc7F)cc6)cc5)cc43)cc2)cc1
InChIInChI=1S/C122H92F4N2O2/c1-9-79-19-63-103(64-20-79)129-105-67-45-93(46-68-105)121(91-41-37-89(38-42-91)119(3,4)5)113-17-13-11-15-109(113)111-71-35-87(75-115(111)121)83-27-55-99(56-28-83)127(101-59-31-85(32-60-101)107-73-49-95(123)77-117(107)125)97-51-23-81(24-52-97)82-25-53-98(54-26-82)128(102-61-33-86(34-62-102)108-74-50-96(124)78-118(108)126)100-57-29-84(30-58-100)88-36-72-112-110-16-12-14-18-114(110)122(116(112)76-88,92-43-39-90(40-44-92)120(6,7)8)94-47-69-106(70-48-94)130-104-65-21-80(10-2)22-66-104/h9-78H,1-2H2,3-8H3
InChIKeyPFLWNMROTPKRST-UHFFFAOYSA-N
XLogP33.71
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds21
Heavy Atoms130
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001694.08
LogP ≤ 533.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline with MolForge

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Related Compounds

9-(4-tert-butylphenyl)-N-[4-[4-[N-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-4-(4-fluorophenyl)anilino]phenyl]phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine
CID 166686240
4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,6-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(3,4-difluorophenyl)phenyl]aniline
CID 167019692
9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[4-[9-[4-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]phenyl]-N,9-bis(4-fluorophenyl)fluoren-2-amine
CID 172547006
3-N,7-N-bis[3-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-3-N,7-N-bis(4-fluorophenyl)dibenzofuran-3,7-diamine
CID 177262599
9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-phenylfluoren-2-yl]-4-fluoroanilino)phenyl]phenyl]-N-(4-fluorophenyl)-9-phenylfluoren-2-amine
CID 166686283
9-(2,4-difluorophenyl)-N-[9-(2,4-difluorophenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-9-[4-(4-ethenylphenoxy)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 167160920
N-(2,4-difluorophenyl)-9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-phenylfluoren-2-yl]-2,4-difluoroanilino)phenyl]phenyl]-9-phenylfluoren-2-amine
CID 167019630
2-N,8-N-bis[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-2-N,8-N-bis(4-fluorophenyl)dibenzofuran-2,8-diamine
CID 177262831
9-(3,4-difluorophenyl)-N-[4-[4-(N-[9-(3,4-difluorophenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-4-fluoroanilino)phenyl]phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-(4-fluorophenyl)fluoren-2-amine
CID 169295027
9-(2,6-difluorophenyl)-N-[9-(2,6-difluorophenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine
CID 167160935
9-(2,6-difluorophenyl)-N-[4-[4-[N-[9-(2,6-difluorophenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-4-(4-fluorophenyl)anilino]phenyl]phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine
CID 169294879
9-(2,6-difluorophenyl)-N-[9-(2,6-difluorophenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[3-(4-fluorophenyl)phenyl]phenyl]fluoren-2-amine
CID 170541530

Frequently Asked Questions

What is the IUPAC name of 4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline?
The IUPAC name of 4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline (CID 166686325) is 4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline.
What is the SMILES notation for 4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline?
The canonical SMILES for 4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline is C=Cc1ccc(Oc2ccc(C3(c4ccc(C(C)(C)C)cc4)c4ccccc4-c4ccc(-c5ccc(N(c6ccc(-c7ccc(N(c8ccc(-c9ccc%10c(c9)C(c9ccc(Oc%11ccc(C=C)cc%11)cc9)(c9ccc(C(C)(C)C)cc9)c9ccccc9-%10)cc8)c8ccc(-c9ccc(F)cc9F)cc8)cc7)cc6)c6ccc(-c7ccc(F)cc7F)cc6)cc5)cc43)cc2)cc1.
What is the InChIKey of 4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline?
The InChIKey is PFLWNMROTPKRST-UHFFFAOYSA-N. The full InChI is InChI=1S/C122H92F4N2O2/c1-9-79-19-63-103(64-20-79)129-105-67-45-93(46-68-105)121(91-41-37-89(38-42-91)119(3,4)5)113-17-13-11-15-109(113)111-71-35-87(75-115(111)121)83-27-55-99(56-28-83)127(101-59-31-85(32-60-101)107-73-49-95(123)77-117(107)125)97-51-23-81(24-52-97)82-25-53-98(54-26-82)128(102-61-33-86(34-62-102)108-74-50-96(124)78-118(108)126)100-57-29-84(30-58-100)88-36-72-112-110-16-12-14-18-114(110)122(116(112)76-88,92-43-39-90(40-44-92)120(6,7)8)94-47-69-106(70-48-94)130-104-65-21-80(10-2)22-66-104/h9-78H,1-2H2,3-8H3.
What are the key properties of 4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline?
4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline has a molecular weight of 1694.08 g/mol, XLogP of 33.71, 21 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-N-[4-(2,4-difluorophenyl)phenyl]anilino]phenyl]-N-[4-[9-(4-tert-butylphenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]phenyl]-N-[4-(2,4-difluorophenyl)phenyl]aniline is sourced from PubChem (CID 166686325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).