CAS 671-95-4|salco|Clofenamide|4-chlorobenzene-1,3-disulfonamide|Frictan|Monochlorphenamide|4-Chloro-1,3-benzenedisulfonamide|Haflutan|Salzen|Aponiere|Indigatin|Eleklin|4-Chloro-m-benzenedisulfonami...

General Information

Structure

Molecular Formula

C₆H₇ClN₂O₄S₂

Molecular Mass

270.71378

Exact Mass

269.95357639

Charge

InChI

InChI=1S/C6H7ClN2O4S2/c7-5-2-1-4(14(8,10)11)3-6(5)15(9,12)13/h1-3H,(H2,8,10,11)(H2,9,12,13)

InChIKey

NENBAISIHCWPKP-UHFFFAOYSA-N

Canonic Smiles

Clc1ccc(cc1S(=O)(=O)N)S(=O)(=O)N

Isomeric Smiles

O=S(=O)(c1cc(ccc1Cl)S(=O)(=O)N)N

Calculated Properties

JChem

Acid pKa

8.588179

H Acceptors

H Donor

LogD (pH = 5.5)

-0.21096192

LogD (pH = 7.4)

-0.23492041

Log P

-0.21064797

Molar Refractivity

55.1786

Polarizability

23.056322

Polar Surface Area

120.32

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Academic Data

Commercial Catalog

Data Source

Names and Identifiers

IUPAC Traditional name

salco

Synonyms

ClofenamideFrictanMonochlorphenamide4-Chloro-1,3-benzenedisulfonamideHaflutanSalzenAponiereIndigatinEleklin4-Chloro-m-benzenedisulfonamideSaltron4-Chlorobenzene-1,3-disulfonamideMacashiSalcoDiumideDiuretic 2822AqueduxClofenamidumSoluran4-chlorobenzene-1,3-disulfonamide

IUPAC name

4-chlorobenzene-1,3-disulfonamide

Names and Identifiers

Registration numbers

Unique Ingredient Identifier

ATC CODE

Wikipedia Title

CAS Number