N-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline

C204H152N10 — CID 159667665

IUPACN-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline
SMILES[3H]c1cccc(N(c2ccc(-c3ccccc3)cc2)c2ccc(N(c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cccc([3H])c4)cc3)c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cccc([3H])c4)cc3)cc2)c1.[3H]c1cccc(N(c2ccc(-c3ccccc3)cc2)c2cccc(-c3cc(-c4cccc(N(c5ccc(-c6ccccc6)cc5)c5cccc([3H])c5)c4)cc(-c4cccc(N(c5ccc(-c6ccccc6)cc5)c5cccc([3H])c5)c4)c3)c2)c1.[3H]c1cccc(N(c2ccccc2)c2ccc(-c3ccc(N(c4ccc(-c5ccc(N(c6ccccc6)c6cccc([3H])c6)cc5)cc4)c4cccc([3H])c4)cc3)cc2)c1
InChIInChI=1S/C78H57N3.C72H54N4.C54H41N3/c1-7-22-58(23-8-1)61-40-46-73(47-41-61)79(70-31-13-4-14-32-70)76-37-19-28-64(55-76)67-52-68(65-29-20-38-77(56-65)80(71-33-15-5-16-34-71)74-48-42-62(43-49-74)59-24-9-2-10-25-59)54-69(53-67)66-30-21-39-78(57-66)81(72-35-17-6-18-36-72)75-50-44-63(45-51-75)60-26-11-3-12-27-60;1-7-19-55(20-8-1)58-31-37-64(38-32-58)73(61-25-13-4-14-26-61)67-43-49-70(50-44-67)76(71-51-45-68(46-52-71)74(62-27-15-5-16-28-62)65-39-33-59(34-40-65)56-21-9-2-10-22-56)72-53-47-69(48-54-72)75(63-29-17-6-18-30-63)66-41-35-60(36-42-66)57-23-11-3-12-24-57;1-6-16-46(17-7-1)55(47-18-8-2-9-19-47)51-34-26-42(27-35-51)44-30-38-53(39-31-44)57(50-24-14-5-15-25-50)54-40-32-45(33-41-54)43-28-36-52(37-29-43)56(48-20-10-3-11-21-48)49-22-12-4-13-23-49/h1-57H;1-54H;1-41H/i2*13T,15T,17T;6T,10T,14T
InChIKeyMTPRGXOHGCLLSK-WQVFRIGRSA-N
MW2761.60 g/mol
LogP58.09
Rot. Bonds41

About N-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline

N-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline (PubChem CID 159667665) has the molecular formula C204H152N10 and a molecular weight of 2761.60 g/mol. Its IUPAC name is N-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline.

Molecular Properties

Compound NameN-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline
PubChem CID159667665
Molecular FormulaC204H152N10
Molecular Weight2761.60 g/mol
Exact Mass2759.29
IUPAC NameN-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline
SMILES[3H]c1cccc(N(c2ccc(-c3ccccc3)cc2)c2ccc(N(c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cccc([3H])c4)cc3)c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cccc([3H])c4)cc3)cc2)c1.[3H]c1cccc(N(c2ccc(-c3ccccc3)cc2)c2cccc(-c3cc(-c4cccc(N(c5ccc(-c6ccccc6)cc5)c5cccc([3H])c5)c4)cc(-c4cccc(N(c5ccc(-c6ccccc6)cc5)c5cccc([3H])c5)c4)c3)c2)c1.[3H]c1cccc(N(c2ccccc2)c2ccc(-c3ccc(N(c4ccc(-c5ccc(N(c6ccccc6)c6cccc([3H])c6)cc5)cc4)c4cccc([3H])c4)cc3)cc2)c1
InChIInChI=1S/C78H57N3.C72H54N4.C54H41N3/c1-7-22-58(23-8-1)61-40-46-73(47-41-61)79(70-31-13-4-14-32-70)76-37-19-28-64(55-76)67-52-68(65-29-20-38-77(56-65)80(71-33-15-5-16-34-71)74-48-42-62(43-49-74)59-24-9-2-10-25-59)54-69(53-67)66-30-21-39-78(57-66)81(72-35-17-6-18-36-72)75-50-44-63(45-51-75)60-26-11-3-12-27-60;1-7-19-55(20-8-1)58-31-37-64(38-32-58)73(61-25-13-4-14-26-61)67-43-49-70(50-44-67)76(71-51-45-68(46-52-71)74(62-27-15-5-16-28-62)65-39-33-59(34-40-65)56-21-9-2-10-22-56)72-53-47-69(48-54-72)75(63-29-17-6-18-30-63)66-41-35-60(36-42-66)57-23-11-3-12-24-57;1-6-16-46(17-7-1)55(47-18-8-2-9-19-47)51-34-26-42(27-35-51)44-30-38-53(39-31-44)57(50-24-14-5-15-25-50)54-40-32-45(33-41-54)43-28-36-52(37-29-43)56(48-20-10-3-11-21-48)49-22-12-4-13-23-49/h1-57H;1-54H;1-41H/i2*13T,15T,17T;6T,10T,14T
InChIKeyMTPRGXOHGCLLSK-WQVFRIGRSA-N
XLogP58.09
TPSA32.40 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds41
Heavy Atoms214
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002761.60
LogP ≤ 558.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze N-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline with MolForge

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Related Compounds

N-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline
CID 59196957
3-[3,5-bis[3-(N-[4-(3-tritiophenyl)phenyl]anilino)phenyl]phenyl]-N-phenyl-N-[4-(3-tritiophenyl)phenyl]aniline;1-N-phenyl-1-N-[4-(3-tritiophenyl)phenyl]-4-N,4-N-bis[4-(N-[4-(3-tritiophenyl)phenyl]anilino)phenyl]benzene-1,4-diamine
CID 159489320
3-phenyl-N-(4-phenylphenyl)-N-(3-tritiophenyl)aniline
CID 59196961
3-[4-(N-phenylanilino)phenyl]-N-[4-[3-[4-(N-phenylanilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 126502501
N,N-diphenyl-3-[3-[3-[4-(N-phenylanilino)phenyl]phenyl]phenyl]aniline
CID 118689272
N,3-diphenyl-N-[4-[4-(3-phenyl-N-(3-phenylphenyl)anilino)phenyl]phenyl]aniline
CID 59090384
N,3-diphenyl-N-[4-[4-(N-[4-[4-(N-[4-[4-(N-(3-phenylphenyl)anilino)phenyl]phenyl]anilino)phenyl]phenyl]anilino)phenyl]phenyl]aniline
CID 22013506
N,N-diphenyl-3-[4-[3-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]aniline;N,N-diphenyl-3-[4-[3-(N-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]anilino)phenyl]phenyl]aniline;N-phenyl-3-[4-[4-(N-phenylanilino)phenyl]phenyl]-N-[3-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]aniline;N-phenyl-3-[4-[4-(N-phenylanilino)phenyl]phenyl]-N-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]aniline
CID 159305688
4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine
CID 59196989
N,N-diphenylaniline;N,4-diphenyl-N-(4-phenylphenyl)aniline;ethane;3-phenyl-N,N-bis(3-phenylphenyl)aniline;4-phenyl-N,N-bis(4-phenylphenyl)aniline;N,N,4-triphenylaniline;N,3,5-triphenyl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 159185873
N-[4-[4-(N-[4-(3,5-diphenylphenyl)phenyl]-4-phenylanilino)phenyl]phenyl]-4-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline;3,5-diphenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-[4-(3-phenylphenyl)phenyl]anilino)phenyl]phenyl]aniline;4-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[4-[4-(4-phenyl-N-[4-(3-phenylphenyl)phenyl]anilino)phenyl]phenyl]aniline
CID 161155086
N-(4-phenylphenyl)-3-tritio-N-[4-(3-tritiophenyl)phenyl]aniline
CID 59196859

Frequently Asked Questions

What is the IUPAC name of N-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline?
The IUPAC name of N-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline (CID 159667665) is N-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline.
What is the SMILES notation for N-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline?
The canonical SMILES for N-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline is [3H]c1cccc(N(c2ccc(-c3ccccc3)cc2)c2ccc(N(c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cccc([3H])c4)cc3)c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cccc([3H])c4)cc3)cc2)c1.[3H]c1cccc(N(c2ccc(-c3ccccc3)cc2)c2cccc(-c3cc(-c4cccc(N(c5ccc(-c6ccccc6)cc5)c5cccc([3H])c5)c4)cc(-c4cccc(N(c5ccc(-c6ccccc6)cc5)c5cccc([3H])c5)c4)c3)c2)c1.[3H]c1cccc(N(c2ccccc2)c2ccc(-c3ccc(N(c4ccc(-c5ccc(N(c6ccccc6)c6cccc([3H])c6)cc5)cc4)c4cccc([3H])c4)cc3)cc2)c1.
What is the InChIKey of N-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline?
The InChIKey is MTPRGXOHGCLLSK-WQVFRIGRSA-N. The full InChI is InChI=1S/C78H57N3.C72H54N4.C54H41N3/c1-7-22-58(23-8-1)61-40-46-73(47-41-61)79(70-31-13-4-14-32-70)76-37-19-28-64(55-76)67-52-68(65-29-20-38-77(56-65)80(71-33-15-5-16-34-71)74-48-42-62(43-49-74)59-24-9-2-10-25-59)54-69(53-67)66-30-21-39-78(57-66)81(72-35-17-6-18-36-72)75-50-44-63(45-51-75)60-26-11-3-12-27-60;1-7-19-55(20-8-1)58-31-37-64(38-32-58)73(61-25-13-4-14-26-61)67-43-49-70(50-44-67)76(71-51-45-68(46-52-71)74(62-27-15-5-16-28-62)65-39-33-59(34-40-65)56-21-9-2-10-22-56)72-53-47-69(48-54-72)75(63-29-17-6-18-30-63)66-41-35-60(36-42-66)57-23-11-3-12-24-57;1-6-16-46(17-7-1)55(47-18-8-2-9-19-47)51-34-26-42(27-35-51)44-30-38-53(39-31-44)57(50-24-14-5-15-25-50)54-40-32-45(33-41-54)43-28-36-52(37-29-43)56(48-20-10-3-11-21-48)49-22-12-4-13-23-49/h1-57H;1-54H;1-41H/i2*13T,15T,17T;6T,10T,14T.
What are the key properties of N-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline?
N-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline has a molecular weight of 2761.60 g/mol, XLogP of 58.09, 41 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[3,5-bis[3-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)-3-tritioaniline;4-N-(4-phenylphenyl)-1-N,1-N-bis[4-(4-phenyl-N-(3-tritiophenyl)anilino)phenyl]-4-N-(3-tritiophenyl)benzene-1,4-diamine;N-phenyl-3-tritio-N-[4-[4-[N-(3-tritiophenyl)-4-[4-(N-(3-tritiophenyl)anilino)phenyl]anilino]phenyl]phenyl]aniline is sourced from PubChem (CID 159667665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).