Methenamine citrateProduct ingredient for Methenamine
- Name
- Methenamine citrate
- 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
- DBSALT002250
- Structure
Structure for Methenamine citrate (DBSALT002250)
- Synonyms
- Not Available
- UNII
- Q4U8R77416
- CAS Number
- 34317-08-3
- Weight
- Average: 332.313
Monoisotopic: 332.133199 - Chemical Formula
- C12H20N4O7
- InChI Key
- UAMIYHCXAONPMG-UHFFFAOYSA-N
- InChI
- InChI=1S/C6H12N4.C6H8O7/c1-7-2-9-4-8(1)5-10(3-7)6-9;7-3(8)1-6(13,5(11)12)2-4(9)10/h1-6H2;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
- IUPAC Name
- 1,3,5,7-tetraazatricyclo[3.3.1.1^{3,7}]decane; 2-hydroxypropane-1,2,3-tricarboxylic acid
- SMILES
- C1N2CN3CN1CN(C2)C3.OC(=O)CC(O)(CC(O)=O)C(O)=O
- External Links
- ChemSpider
- 106021
- Predicted Properties
Property Value Source Water Solubility 106.0 mg/mL ALOGPS logP -1.3 ALOGPS logP -1.3 Chemaxon logS -0.26 ALOGPS pKa (Strongest Acidic) 3.05 Chemaxon pKa (Strongest Basic) -4.2 Chemaxon Physiological Charge -3 Chemaxon Hydrogen Acceptor Count 7 Chemaxon Hydrogen Donor Count 4 Chemaxon Polar Surface Area 132.13 Å2 Chemaxon Rotatable Bond Count 5 Chemaxon Refractivity 35.62 m3·mol-1 Chemaxon Polarizability 15.51 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon