Trospium chlorideProduct ingredient for Trospium

Name
Trospium chloride
Drug Entry
Trospium

Trospium is an antispasmodic agent used to treat the symptoms of overactive bladder, a condition that causes the bladder muscles to contract uncontrollably.1 An overactive bladder leads to an increased urge to urinate, frequent urination, and sometimes, loss of control over urination.1 Trospium is manufactured by Indevus Pharmaceutical Inc. and was granted FDA approval in 2007.2

Accession Number
DBSALT000883
Structure
Synonyms
Not Available
UNII
1E6682427E
CAS Number
10405-02-4
Weight
Average: 427.97
Monoisotopic: 427.1914215
Chemical Formula
C25H30ClNO3
InChI Key
RVCSYOQWLPPAOA-QKYUOBHYSA-M
InChI
InChI=1S/C25H30NO3.ClH/c27-24(25(28,19-9-3-1-4-10-19)20-11-5-2-6-12-20)29-23-17-21-13-14-22(18-23)26(21)15-7-8-16-26;/h1-6,9-12,21-23,28H,7-8,13-18H2;1H/q+1;/p-1/t21-,22+,23+;
IUPAC Name
(1R,3S,5S)-3-[(2-hydroxy-2,2-diphenylacetyl)oxy]-8λ⁵-azaspiro[bicyclo[3.2.1]octane-8,1'-pyrrolidin]-8-ylium chloride
SMILES
[Cl-].[H][C@]12CC[C@]([H])(C[C@@]([H])(C1)OC(=O)C(O)(C1=CC=CC=C1)C1=CC=CC=C1)[N+]21CCCC1
PubChem Compound
66524159
ChemSpider
16740183
ChEBI
32270
ChEMBL
CHEMBL3084748
Wikipedia
Trospium_chloride
Predicted Properties
PropertyValueSource
Water Solubility7.92e-05 mg/mLALOGPS
logP0.55ALOGPS
logP-0.5ChemAxon
logS-6.7ALOGPS
pKa (Strongest Acidic)11.05ChemAxon
pKa (Strongest Basic)-4.5ChemAxon
Physiological Charge1ChemAxon
Hydrogen Acceptor Count2ChemAxon
Hydrogen Donor Count1ChemAxon
Polar Surface Area46.53 Å2ChemAxon
Rotatable Bond Count5ChemAxon
Refractivity124.04 m3·mol-1ChemAxon
Polarizability43.95 Å3ChemAxon
Number of Rings5ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon