Saccharin sodiumProduct ingredient for Saccharin

Name
Saccharin sodium
Drug Entry
Saccharin

Saccharin has been investigated for the treatment of Hypertension and Hyperglycemia.

Accession Number
DBSALT002240
Structure
Synonyms
Not Available
UNII
SB8ZUX40TY
CAS Number
6155-57-3
Weight
Average: 241.19
Monoisotopic: 241.00208782
Chemical Formula
C7H8NNaO5S
InChI Key
AYGJDUHQRFKLBG-UHFFFAOYSA-M
InChI
InChI=1S/C7H5NO3S.Na.2H2O/c9-7-5-3-1-2-4-6(5)12(10,11)8-7;;;/h1-4H,(H,8,9);;2*1H2/q;+1;;/p-1
IUPAC Name
sodium 1,1,3-trioxo-2,3-dihydro-1lambda6,2-benzothiazol-2-ide dihydrate
SMILES
O.O.[Na+].O=C1[N-]S(=O)(=O)C2=CC=CC=C12
ChemSpider
21130
ChEMBL
CHEMBL2105416
Predicted Properties
PropertyValueSource
Water Solubility17.5 mg/mLALOGPS
logP0.67ALOGPS
logP0.45ChemAxon
logS-1.1ALOGPS
pKa (Strongest Acidic)1.94ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count4ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area60.44 Å2ChemAxon
Rotatable Bond Count0ChemAxon
Refractivity41.59 m3·mol-1ChemAxon
Polarizability15.6 Å3ChemAxon
Number of Rings2ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon