N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine

C166H116N6Se3 — CID 159477091

IUPACN-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N(c5cccc6ccccc56)c5cccc6c5[se]c5ccccc56)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N(c5ccccc5)c5ccc6[se]c7ccccc7c6c5)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N(c5ccccc5)c5cccc6c5[se]c5ccccc56)cc4)cc3)cc2)cc1
InChIInChI=1S/C58H40N2Se.2C54H38N2Se/c1-3-13-41(14-4-1)43-25-33-48(34-26-43)59(49-35-27-44(28-36-49)42-15-5-2-6-16-42)50-37-29-45(30-38-50)46-31-39-51(40-32-46)60(55-22-11-18-47-17-7-8-19-52(47)55)56-23-12-21-54-53-20-9-10-24-57(53)61-58(54)56;1-4-13-39(14-5-1)41-23-31-46(32-24-41)55(47-33-25-42(26-34-47)40-15-6-2-7-16-40)48-35-27-43(28-36-48)44-29-37-49(38-30-44)56(45-17-8-3-9-18-45)52-21-12-20-51-50-19-10-11-22-53(50)57-54(51)52;1-4-12-39(13-5-1)41-20-28-46(29-21-41)55(47-30-22-42(23-31-47)40-14-6-2-7-15-40)48-32-24-43(25-33-48)44-26-34-49(35-27-44)56(45-16-8-3-9-17-45)50-36-37-54-52(38-50)51-18-10-11-19-53(51)57-54/h1-40H;2*1-38H
InChIKeyLWNAVJORKGRXRU-UHFFFAOYSA-N
MW2431.68 g/mol
LogP46.12
Rot. Bonds27

About N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine

N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine (PubChem CID 159477091) has the molecular formula C166H116N6Se3 and a molecular weight of 2431.68 g/mol. Its IUPAC name is N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine.

Molecular Properties

Compound NameN-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine
PubChem CID159477091
Molecular FormulaC166H116N6Se3
Molecular Weight2431.68 g/mol
Exact Mass2432.68
IUPAC NameN-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N(c5cccc6ccccc56)c5cccc6c5[se]c5ccccc56)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N(c5ccccc5)c5ccc6[se]c7ccccc7c6c5)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N(c5ccccc5)c5cccc6c5[se]c5ccccc56)cc4)cc3)cc2)cc1
InChIInChI=1S/C58H40N2Se.2C54H38N2Se/c1-3-13-41(14-4-1)43-25-33-48(34-26-43)59(49-35-27-44(28-36-49)42-15-5-2-6-16-42)50-37-29-45(30-38-50)46-31-39-51(40-32-46)60(55-22-11-18-47-17-7-8-19-52(47)55)56-23-12-21-54-53-20-9-10-24-57(53)61-58(54)56;1-4-13-39(14-5-1)41-23-31-46(32-24-41)55(47-33-25-42(26-34-47)40-15-6-2-7-16-40)48-35-27-43(28-36-48)44-29-37-49(38-30-44)56(45-17-8-3-9-18-45)52-21-12-20-51-50-19-10-11-22-53(50)57-54(51)52;1-4-12-39(13-5-1)41-20-28-46(29-21-41)55(47-30-22-42(23-31-47)40-14-6-2-7-15-40)48-32-24-43(25-33-48)44-26-34-49(35-27-44)56(45-16-8-3-9-17-45)50-36-37-54-52(38-50)51-18-10-11-19-53(51)57-54/h1-40H;2*1-38H
InChIKeyLWNAVJORKGRXRU-UHFFFAOYSA-N
XLogP46.12
TPSA19.44 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds27
Heavy Atoms175
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002431.68
LogP ≤ 546.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine?
The IUPAC name of N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine (CID 159477091) is N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine.
What is the SMILES notation for N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine?
The canonical SMILES for N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine is c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N(c5cccc6ccccc56)c5cccc6c5[se]c5ccccc56)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N(c5ccccc5)c5ccc6[se]c7ccccc7c6c5)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N(c5ccccc5)c5cccc6c5[se]c5ccccc56)cc4)cc3)cc2)cc1.
What is the InChIKey of N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine?
The InChIKey is LWNAVJORKGRXRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H40N2Se.2C54H38N2Se/c1-3-13-41(14-4-1)43-25-33-48(34-26-43)59(49-35-27-44(28-36-49)42-15-5-2-6-16-42)50-37-29-45(30-38-50)46-31-39-51(40-32-46)60(55-22-11-18-47-17-7-8-19-52(47)55)56-23-12-21-54-53-20-9-10-24-57(53)61-58(54)56;1-4-13-39(14-5-1)41-23-31-46(32-24-41)55(47-33-25-42(26-34-47)40-15-6-2-7-16-40)48-35-27-43(28-36-48)44-29-37-49(38-30-44)56(45-17-8-3-9-18-45)52-21-12-20-51-50-19-10-11-22-53(50)57-54(51)52;1-4-12-39(13-5-1)41-20-28-46(29-21-41)55(47-30-22-42(23-31-47)40-14-6-2-7-15-40)48-32-24-43(25-33-48)44-26-34-49(35-27-44)56(45-16-8-3-9-17-45)50-36-37-54-52(38-50)51-18-10-11-19-53(51)57-54/h1-40H;2*1-38H.
What are the key properties of N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine?
N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine has a molecular weight of 2431.68 g/mol, XLogP of 46.12, 27 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-2-amine;N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzoselenophen-4-amine is sourced from PubChem (CID 159477091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).