N-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine

C34H21NSe2 — CID 171445541

IUPACN-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine
SMILESc1ccc(N(c2ccc3[se]c4c5ccccc5ccc4c3c2)c2cccc3c2[se]c2ccccc23)cc1
InChIInChI=1S/C34H21NSe2/c1-2-10-23(11-3-1)35(30-15-8-14-27-26-13-6-7-16-31(26)37-34(27)30)24-18-20-32-29(21-24)28-19-17-22-9-4-5-12-25(22)33(28)36-32/h1-21H
InChIKeyXAPLTSPTNLPNQZ-UHFFFAOYSA-N
MW601.47 g/mol
LogP9.04
Rot. Bonds3

About N-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine

N-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine (PubChem CID 171445541) has the molecular formula C34H21NSe2 and a molecular weight of 601.47 g/mol. Its IUPAC name is N-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine.

Molecular Properties

Compound NameN-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine
PubChem CID171445541
Molecular FormulaC34H21NSe2
Molecular Weight601.47 g/mol
Exact Mass603.00
IUPAC NameN-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine
SMILESc1ccc(N(c2ccc3[se]c4c5ccccc5ccc4c3c2)c2cccc3c2[se]c2ccccc23)cc1
InChIInChI=1S/C34H21NSe2/c1-2-10-23(11-3-1)35(30-15-8-14-27-26-13-6-7-16-31(26)37-34(27)30)24-18-20-32-29(21-24)28-19-17-22-9-4-5-12-25(22)33(28)36-32/h1-21H
InChIKeyXAPLTSPTNLPNQZ-UHFFFAOYSA-N
XLogP9.04
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500601.47
LogP ≤ 59.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-phenyl-N-(2-phenylphenyl)naphtho[1,2-b][1]benzoselenol-8-amine
CID 171445539
N-[4-[4-(N-[4-[4-(N-dibenzoselenophen-2-ylanilino)phenyl]phenyl]anilino)phenyl]phenyl]-N-phenyldibenzoselenophen-2-amine;N-[4-[4-(N-[4-[4-(N-dibenzoselenophen-4-ylanilino)phenyl]phenyl]anilino)phenyl]phenyl]-N-phenyldibenzoselenophen-4-amine;4-N-dibenzoselenophen-2-yl-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-dibenzoselenophen-4-yl-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine
CID 161075010
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
N-(2-phenylphenyl)-N-(4-phenylphenyl)naphtho[1,2-b][1]benzoselenol-8-amine
CID 171445640
N-phenanthren-3-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-3-amine
CID 171445365
N-phenyl-N-(2-phenylphenyl)naphtho[1,2-b][1]benzoselenol-9-amine
CID 171445514
3-naphtho[1,2-b][1]benzoselenol-8-yl-N-phenyl-N-(4-phenylphenyl)aniline
CID 171445424
N-(3,5-diphenylphenyl)-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine
CID 171445606
N-dibenzoselenophen-4-yl-N-phenyldibenzoselenophen-4-amine
CID 59245757
N-(3-phenylphenyl)-N-(4-phenylphenyl)naphtho[1,2-b][1]benzoselenol-2-amine
CID 171445650
N-dibenzoselenophen-4-yl-N-naphtho[1,2-b][1]benzoselenol-3-yldibenzofuran-3-amine
CID 171445354
N-phenyl-N-[2-(2-phenylphenyl)phenyl]naphtho[1,2-b][1]benzoselenol-3-amine
CID 171445480

Frequently Asked Questions

What is the IUPAC name of N-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine?
The IUPAC name of N-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine (CID 171445541) is N-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine.
What is the SMILES notation for N-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine?
The canonical SMILES for N-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine is c1ccc(N(c2ccc3[se]c4c5ccccc5ccc4c3c2)c2cccc3c2[se]c2ccccc23)cc1.
What is the InChIKey of N-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine?
The InChIKey is XAPLTSPTNLPNQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H21NSe2/c1-2-10-23(11-3-1)35(30-15-8-14-27-26-13-6-7-16-31(26)37-34(27)30)24-18-20-32-29(21-24)28-19-17-22-9-4-5-12-25(22)33(28)36-32/h1-21H.
What are the key properties of N-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine?
N-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine has a molecular weight of 601.47 g/mol, XLogP of 9.04, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzoselenophen-4-yl-N-phenylnaphtho[1,2-b][1]benzoselenol-8-amine is sourced from PubChem (CID 171445541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).