4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine

C224H162N18O — CID 159168572

IUPAC4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine
SMILESc1ccc(N(c2ccccc2)c2ccc(N(c3ccc(-c4ccc(-c5ccc(N(c6ccc(N(c7ccccc7)c7ccccc7)cc6)c6cccc7ccccc67)cc5)n4-c4ccccc4)cc3)c3cccc4ccccc34)cc2)cc1.c1ccc(N(c2ccccc2)c2ccc(N(c3ccc(-c4nnc(-c5ccc(N(c6ccc(N(c7ccccc7)c7ccccc7)cc6)c6cccc7ccccc67)cc5)n4-c4ccccc4)cc3)c3cccc4ccccc34)cc2)cc1.c1ccc(N(c2ccccc2)c2ccc(N(c3ccc(-c4nnc(-c5ccc(N(c6ccc(N(c7ccccc7)c7ccccc7)cc6)c6cccc7ccccc67)cc5)o4)cc3)c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C78H57N5.C76H55N7.C70H50N6O/c1-6-26-62(27-7-1)79(63-28-8-2-9-29-63)67-48-52-71(53-49-67)81(77-38-20-24-58-22-16-18-36-73(58)77)69-44-40-60(41-45-69)75-56-57-76(83(75)66-34-14-5-15-35-66)61-42-46-70(47-43-61)82(78-39-21-25-59-23-17-19-37-74(59)78)72-54-50-68(51-55-72)80(64-30-10-3-11-31-64)65-32-12-4-13-33-65;1-6-26-60(27-7-1)79(61-28-8-2-9-29-61)65-48-52-69(53-49-65)81(73-38-20-24-56-22-16-18-36-71(56)73)67-44-40-58(41-45-67)75-77-78-76(83(75)64-34-14-5-15-35-64)59-42-46-68(47-43-59)82(74-39-21-25-57-23-17-19-37-72(57)74)70-54-50-66(51-55-70)80(62-30-10-3-11-31-62)63-32-12-4-13-33-63;1-5-23-55(24-6-1)73(56-25-7-2-8-26-56)59-43-47-63(48-44-59)75(67-33-17-21-51-19-13-15-31-65(51)67)61-39-35-53(36-40-61)69-71-72-70(77-69)54-37-41-62(42-38-54)76(68-34-18-22-52-20-14-16-32-66(52)68)64-49-45-60(46-50-64)74(57-27-9-3-10-28-57)58-29-11-4-12-30-58/h1-57H;1-55H;1-50H
InChIKeyKLJUJRZQIYDFQV-UHFFFAOYSA-N
MW3121.88 g/mol
LogP62.37
Rot. Bonds44

About 4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine

4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine (PubChem CID 159168572) has the molecular formula C224H162N18O and a molecular weight of 3121.88 g/mol. Its IUPAC name is 4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine.

Molecular Properties

Compound Name4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine
PubChem CID159168572
Molecular FormulaC224H162N18O
Molecular Weight3121.88 g/mol
Exact Mass3119.32
IUPAC Name4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine
SMILESc1ccc(N(c2ccccc2)c2ccc(N(c3ccc(-c4ccc(-c5ccc(N(c6ccc(N(c7ccccc7)c7ccccc7)cc6)c6cccc7ccccc67)cc5)n4-c4ccccc4)cc3)c3cccc4ccccc34)cc2)cc1.c1ccc(N(c2ccccc2)c2ccc(N(c3ccc(-c4nnc(-c5ccc(N(c6ccc(N(c7ccccc7)c7ccccc7)cc6)c6cccc7ccccc67)cc5)n4-c4ccccc4)cc3)c3cccc4ccccc34)cc2)cc1.c1ccc(N(c2ccccc2)c2ccc(N(c3ccc(-c4nnc(-c5ccc(N(c6ccc(N(c7ccccc7)c7ccccc7)cc6)c6cccc7ccccc67)cc5)o4)cc3)c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C78H57N5.C76H55N7.C70H50N6O/c1-6-26-62(27-7-1)79(63-28-8-2-9-29-63)67-48-52-71(53-49-67)81(77-38-20-24-58-22-16-18-36-73(58)77)69-44-40-60(41-45-69)75-56-57-76(83(75)66-34-14-5-15-35-66)61-42-46-70(47-43-61)82(78-39-21-25-59-23-17-19-37-74(59)78)72-54-50-68(51-55-72)80(64-30-10-3-11-31-64)65-32-12-4-13-33-65;1-6-26-60(27-7-1)79(61-28-8-2-9-29-61)65-48-52-69(53-49-65)81(73-38-20-24-56-22-16-18-36-71(56)73)67-44-40-58(41-45-67)75-77-78-76(83(75)64-34-14-5-15-35-64)59-42-46-68(47-43-59)82(74-39-21-25-57-23-17-19-37-72(57)74)70-54-50-66(51-55-70)80(62-30-10-3-11-31-62)63-32-12-4-13-33-63;1-5-23-55(24-6-1)73(56-25-7-2-8-26-56)59-43-47-63(48-44-59)75(67-33-17-21-51-19-13-15-31-65(51)67)61-39-35-53(36-40-61)69-71-72-70(77-69)54-37-41-62(42-38-54)76(68-34-18-22-52-20-14-16-32-66(52)68)64-49-45-60(46-50-64)74(57-27-9-3-10-28-57)58-29-11-4-12-30-58/h1-57H;1-55H;1-50H
InChIKeyKLJUJRZQIYDFQV-UHFFFAOYSA-N
XLogP62.37
TPSA113.44 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds44
Heavy Atoms243
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003121.88
LogP ≤ 562.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze 4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine?
The IUPAC name of 4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine (CID 159168572) is 4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine.
What is the SMILES notation for 4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine?
The canonical SMILES for 4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine is c1ccc(N(c2ccccc2)c2ccc(N(c3ccc(-c4ccc(-c5ccc(N(c6ccc(N(c7ccccc7)c7ccccc7)cc6)c6cccc7ccccc67)cc5)n4-c4ccccc4)cc3)c3cccc4ccccc34)cc2)cc1.c1ccc(N(c2ccccc2)c2ccc(N(c3ccc(-c4nnc(-c5ccc(N(c6ccc(N(c7ccccc7)c7ccccc7)cc6)c6cccc7ccccc67)cc5)n4-c4ccccc4)cc3)c3cccc4ccccc34)cc2)cc1.c1ccc(N(c2ccccc2)c2ccc(N(c3ccc(-c4nnc(-c5ccc(N(c6ccc(N(c7ccccc7)c7ccccc7)cc6)c6cccc7ccccc67)cc5)o4)cc3)c3cccc4ccccc34)cc2)cc1.
What is the InChIKey of 4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine?
The InChIKey is KLJUJRZQIYDFQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C78H57N5.C76H55N7.C70H50N6O/c1-6-26-62(27-7-1)79(63-28-8-2-9-29-63)67-48-52-71(53-49-67)81(77-38-20-24-58-22-16-18-36-73(58)77)69-44-40-60(41-45-69)75-56-57-76(83(75)66-34-14-5-15-35-66)61-42-46-70(47-43-61)82(78-39-21-25-59-23-17-19-37-74(59)78)72-54-50-68(51-55-72)80(64-30-10-3-11-31-64)65-32-12-4-13-33-65;1-6-26-60(27-7-1)79(61-28-8-2-9-29-61)65-48-52-69(53-49-65)81(73-38-20-24-56-22-16-18-36-71(56)73)67-44-40-58(41-45-67)75-77-78-76(83(75)64-34-14-5-15-35-64)59-42-46-68(47-43-59)82(74-39-21-25-57-23-17-19-37-72(57)74)70-54-50-66(51-55-70)80(62-30-10-3-11-31-62)63-32-12-4-13-33-63;1-5-23-55(24-6-1)73(56-25-7-2-8-26-56)59-43-47-63(48-44-59)75(67-33-17-21-51-19-13-15-31-65(51)67)61-39-35-53(36-40-61)69-71-72-70(77-69)54-37-41-62(42-38-54)76(68-34-18-22-52-20-14-16-32-66(52)68)64-49-45-60(46-50-64)74(57-27-9-3-10-28-57)58-29-11-4-12-30-58/h1-57H;1-55H;1-50H.
What are the key properties of 4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine?
4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine has a molecular weight of 3121.88 g/mol, XLogP of 62.37, 44 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-1-phenylpyrrol-2-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-naphthalen-1-yl-4-N-[4-[5-[4-[N-naphthalen-1-yl-4-(N-phenylanilino)anilino]phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine is sourced from PubChem (CID 159168572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).