N-(4-phenyldiazenylphenyl)benzenesulfonamide

C18H15N3O2S — CID 5058764

IUPACN-(4-phenyldiazenylphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(/N=N/c2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C18H15N3O2S/c22-24(23,18-9-5-2-6-10-18)21-17-13-11-16(12-14-17)20-19-15-7-3-1-4-8-15/h1-14,21H/b20-19+
InChIKeyJGHSIHWEEQODNJ-FMQUCBEESA-N
MW337.40 g/mol
LogP4.90
Rot. Bonds5

About N-(4-phenyldiazenylphenyl)benzenesulfonamide

N-(4-phenyldiazenylphenyl)benzenesulfonamide (PubChem CID 5058764) has the molecular formula C18H15N3O2S and a molecular weight of 337.40 g/mol. Its IUPAC name is N-(4-phenyldiazenylphenyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(4-phenyldiazenylphenyl)benzenesulfonamide
PubChem CID5058764
Molecular FormulaC18H15N3O2S
Molecular Weight337.40 g/mol
Exact Mass337.09
IUPAC NameN-(4-phenyldiazenylphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(/N=N/c2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C18H15N3O2S/c22-24(23,18-9-5-2-6-10-18)21-17-13-11-16(12-14-17)20-19-15-7-3-1-4-8-15/h1-14,21H/b20-19+
InChIKeyJGHSIHWEEQODNJ-FMQUCBEESA-N
XLogP4.90
TPSA70.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.40
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

Analyze N-(4-phenyldiazenylphenyl)benzenesulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-phenyldiazenylphenyl)benzenesulfonamide?
The IUPAC name of N-(4-phenyldiazenylphenyl)benzenesulfonamide (CID 5058764) is N-(4-phenyldiazenylphenyl)benzenesulfonamide.
What is the SMILES notation for N-(4-phenyldiazenylphenyl)benzenesulfonamide?
The canonical SMILES for N-(4-phenyldiazenylphenyl)benzenesulfonamide is O=S(=O)(Nc1ccc(/N=N/c2ccccc2)cc1)c1ccccc1.
What is the InChIKey of N-(4-phenyldiazenylphenyl)benzenesulfonamide?
The InChIKey is JGHSIHWEEQODNJ-FMQUCBEESA-N. The full InChI is InChI=1S/C18H15N3O2S/c22-24(23,18-9-5-2-6-10-18)21-17-13-11-16(12-14-17)20-19-15-7-3-1-4-8-15/h1-14,21H/b20-19+.
What are the key properties of N-(4-phenyldiazenylphenyl)benzenesulfonamide?
N-(4-phenyldiazenylphenyl)benzenesulfonamide has a molecular weight of 337.40 g/mol, XLogP of 4.90, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenyldiazenylphenyl)benzenesulfonamide is sourced from PubChem (CID 5058764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).