N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline

C110H77F3N4O2 — CID 160761682

IUPACN-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline
SMILESCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1.FC(F)(F)Oc1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1
InChIInChI=1S/C55H37F3N2O.C55H40N2O/c56-55(57,58)61-50-36-26-45(27-37-50)44-22-32-48(33-23-44)59(46-28-18-41(19-29-46)40-16-14-39(15-17-40)38-8-2-1-3-9-38)47-30-20-42(21-31-47)43-24-34-49(35-25-43)60-53-12-6-4-10-51(53)52-11-5-7-13-54(52)60;1-58-51-37-27-46(28-38-51)45-23-33-49(34-24-45)56(47-29-19-42(20-30-47)41-17-15-40(16-18-41)39-9-3-2-4-10-39)48-31-21-43(22-32-48)44-25-35-50(36-26-44)57-54-13-7-5-11-52(54)53-12-6-8-14-55(53)57/h1-37H;2-38H,1H3
InChIKeyRYDNYBSFJYVPPS-UHFFFAOYSA-N
MW1543.85 g/mol
LogP30.75
Rot. Bonds18

About N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline

N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline (PubChem CID 160761682) has the molecular formula C110H77F3N4O2 and a molecular weight of 1543.85 g/mol. Its IUPAC name is N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline.

Molecular Properties

Compound NameN-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline
PubChem CID160761682
Molecular FormulaC110H77F3N4O2
Molecular Weight1543.85 g/mol
Exact Mass1542.60
IUPAC NameN-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline
SMILESCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1.FC(F)(F)Oc1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1
InChIInChI=1S/C55H37F3N2O.C55H40N2O/c56-55(57,58)61-50-36-26-45(27-37-50)44-22-32-48(33-23-44)59(46-28-18-41(19-29-46)40-16-14-39(15-17-40)38-8-2-1-3-9-38)47-30-20-42(21-31-47)43-24-34-49(35-25-43)60-53-12-6-4-10-51(53)52-11-5-7-13-54(52)60;1-58-51-37-27-46(28-38-51)45-23-33-49(34-24-45)56(47-29-19-42(20-30-47)41-17-15-40(16-18-41)39-9-3-2-4-10-39)48-31-21-43(22-32-48)44-25-35-50(36-26-44)57-54-13-7-5-11-52(54)53-12-6-8-14-55(53)57/h1-37H;2-38H,1H3
InChIKeyRYDNYBSFJYVPPS-UHFFFAOYSA-N
XLogP30.75
TPSA34.80 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds18
Heavy Atoms119
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001543.85
LogP ≤ 530.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline?
The IUPAC name of N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline (CID 160761682) is N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline.
What is the SMILES notation for N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline?
The canonical SMILES for N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline is COc1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1.FC(F)(F)Oc1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1.
What is the InChIKey of N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline?
The InChIKey is RYDNYBSFJYVPPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H37F3N2O.C55H40N2O/c56-55(57,58)61-50-36-26-45(27-37-50)44-22-32-48(33-23-44)59(46-28-18-41(19-29-46)40-16-14-39(15-17-40)38-8-2-1-3-9-38)47-30-20-42(21-31-47)43-24-34-49(35-25-43)60-53-12-6-4-10-51(53)52-11-5-7-13-54(52)60;1-58-51-37-27-46(28-38-51)45-23-33-49(34-24-45)56(47-29-19-42(20-30-47)41-17-15-40(16-18-41)39-9-3-2-4-10-39)48-31-21-43(22-32-48)44-25-35-50(36-26-44)57-54-13-7-5-11-52(54)53-12-6-8-14-55(53)57/h1-37H;2-38H,1H3.
What are the key properties of N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline?
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline has a molecular weight of 1543.85 g/mol, XLogP of 30.75, 18 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-methoxyphenyl)phenyl]-4-(4-phenylphenyl)aniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline is sourced from PubChem (CID 160761682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).