1,2-diphenylethenesulfonamide

C14H13NO2S — CID 54513105

IUPAC1,2-diphenylethenesulfonamide
SMILESNS(=O)(=O)C(=Cc1ccccc1)c1ccccc1
InChIInChI=1S/C14H13NO2S/c15-18(16,17)14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-11H,(H2,15,16,17)
InChIKeyYKNJFMGWVKOOJS-UHFFFAOYSA-N
MW259.33 g/mol
LogP2.47
Rot. Bonds3

About 1,2-diphenylethenesulfonamide

1,2-diphenylethenesulfonamide (PubChem CID 54513105) has the molecular formula C14H13NO2S and a molecular weight of 259.33 g/mol. Its IUPAC name is 1,2-diphenylethenesulfonamide.

Molecular Properties

Compound Name1,2-diphenylethenesulfonamide
PubChem CID54513105
Molecular FormulaC14H13NO2S
Molecular Weight259.33 g/mol
Exact Mass259.07
IUPAC Name1,2-diphenylethenesulfonamide
SMILESNS(=O)(=O)C(=Cc1ccccc1)c1ccccc1
InChIInChI=1S/C14H13NO2S/c15-18(16,17)14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-11H,(H2,15,16,17)
InChIKeyYKNJFMGWVKOOJS-UHFFFAOYSA-N
XLogP2.47
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.33
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1,2-diphenylethenesulfonamide 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

2-phenyl-1-[4-[4-(2-phenyl-1-sulfoethenyl)phenyl]phenyl]ethenesulfonic acid
CID 54085453
(Z)-1,2-diphenylethenesulfonic acid;4-methylaniline
CID 5351957
4-methylaniline;(E)-2-(4-methylphenyl)-1-phenylethenesulfonic acid
CID 90486972
2,4-diamino-1,5-diphenylpenta-1,4-dien-3-one
CID 66616036
(Z)-2,3-diphenylprop-2-enamide
CID 6016357
3-[(Z)-1-(benzenesulfonyl)-2-phenylethenyl]pyridine
CID 169237898
2,3-diphenylprop-2-enylsulfamic acid
CID 174655398
CID 173126547
CID 173126547
[(Z)-2-nitro-2-phenylethenyl]benzene
CID 2818500
(Z)-2-[(Z)-3-oxo-1,3-diphenylprop-1-en-2-yl]sulfanyl-1,3-diphenylprop-2-en-1-one
CID 11476367
CID 172794141
CID 172794141
2-(2-phenylethenyl)benzenesulfonamide
CID 149433310

Frequently Asked Questions

What is the IUPAC name of 1,2-diphenylethenesulfonamide?
The IUPAC name of 1,2-diphenylethenesulfonamide (CID 54513105) is 1,2-diphenylethenesulfonamide.
What is the SMILES notation for 1,2-diphenylethenesulfonamide?
The canonical SMILES for 1,2-diphenylethenesulfonamide is NS(=O)(=O)C(=Cc1ccccc1)c1ccccc1.
What is the InChIKey of 1,2-diphenylethenesulfonamide?
The InChIKey is YKNJFMGWVKOOJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2S/c15-18(16,17)14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-11H,(H2,15,16,17).
What are the key properties of 1,2-diphenylethenesulfonamide?
1,2-diphenylethenesulfonamide has a molecular weight of 259.33 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diphenylethenesulfonamide is sourced from PubChem (CID 54513105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).