Methenamine sulfateProduct ingredient for Methenamine

Name
Methenamine sulfate
Drug Entry
Methenamine

Methenamine is a heterocyclic organic compound with a cage-like structure similar to adamantane. In salt form it is used for the treatment of urinary tract infection (Example: methenamine hippurate which is the hippuric acid salt of methenamine).

Accession Number
DBSALT002246
Structure
Synonyms
Not Available
UNII
0373WW6GZQ
CAS Number
19267-18-6
Weight
Average: 238.26
Monoisotopic: 238.073576121
Chemical Formula
C6H14N4O4S
InChI Key
CCCDIBJJOMJPQI-UHFFFAOYSA-N
InChI
InChI=1S/C6H12N4.H2O4S/c1-7-2-9-4-8(1)5-10(3-7)6-9;1-5(2,3)4/h1-6H2;(H2,1,2,3,4)
IUPAC Name
1,3,5,7-tetraazatricyclo[3.3.1.1^{3,7}]decane; sulfuric acid
SMILES
OS(O)(=O)=O.C1N2CN3CN1CN(C2)C3
ChemSpider
14596531
Predicted Properties
PropertyValueSource
Water Solubility766.0 mg/mLALOGPS
logP-1.4ALOGPS
logP0.39Chemaxon
logS0.74ALOGPS
pKa (Strongest Basic)5.88Chemaxon
Physiological Charge0Chemaxon
Hydrogen Acceptor Count4Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area12.96 Å2Chemaxon
Rotatable Bond Count0Chemaxon
Refractivity37 m3·mol-1Chemaxon
Polarizability14.25 Å3Chemaxon
Number of Rings3Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterNoChemaxon
Veber's RuleYesChemaxon
MDDR-like RuleNoChemaxon