Etozolin hydrochlorideProduct ingredient for Etozoline

Name
Etozolin hydrochloride
Drug Entry
Etozoline

Etozoline is marketed in Europe under the names Diulozin, Elkapin, and Etopinil. Etozoline is a loop diuretic.

Accession Number
DBSALT002351
Structure
Synonyms
Not Available
UNII
92BYI8Y56J
CAS Number
53-90-7
Weight
Average: 320.83
Monoisotopic: 320.0961414
Chemical Formula
C13H21ClN2O3S
InChI Key
AOHAFCXGDWOODX-KVVVOXFISA-N
InChI
InChI=1S/C13H20N2O3S.ClH/c1-3-18-11(16)9-10-14(2)12(17)13(19-10)15-7-5-4-6-8-15;/h9,13H,3-8H2,1-2H3;1H/b10-9-;
IUPAC Name
ethyl 2-[(2Z)-3-methyl-4-oxo-5-(piperidin-1-yl)-1,3-thiazolidin-2-ylidene]acetate hydrochloride
SMILES
Cl.CCOC(=O)\C=C1/SC(N2CCCCC2)C(=O)N1C
ChemSpider
52083334
Predicted Properties
PropertyValueSource
Water Solubility5.63 mg/mLALOGPS
logP2.27ALOGPS
logP1.92Chemaxon
logS-1.7ALOGPS
pKa (Strongest Basic)5.35Chemaxon
Physiological Charge0Chemaxon
Hydrogen Acceptor Count3Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area49.85 Å2Chemaxon
Rotatable Bond Count4Chemaxon
Refractivity85.5 m3·mol-1Chemaxon
Polarizability30.57 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon