Fimasartan potassium trihydrateProduct ingredient for Fimasartan

Name
Fimasartan potassium trihydrate
Drug Entry
Fimasartan

Fimasartan is an angiotensin II receptor antagonist (ARB) drug employed in the treatment of both hypertension and heart failure. It has been found to be safe when administered with hydrochlorothiazide (a diuretic) in clinical trials. Fimasartan was initially approved September 9th, 2010 in South Korea and is marketed under the brand name Kanarb by Boryung Pharmaceuticals.

Accession Number
DBSALT001281
Structure
Synonyms
Not Available
UNII
4516BN0T4B
CAS Number
1020110-23-9
Weight
Average: 593.79
Monoisotopic: 593.21865533
Chemical Formula
C27H36KN7O4S
InChI Key
IJEKJHQBGZFMMI-UHFFFAOYSA-N
InChI
InChI=1S/C27H30N7OS.K.3H2O/c1-5-6-11-24-28-18(2)23(16-25(36)33(3)4)27(35)34(24)17-19-12-14-20(15-13-19)21-9-7-8-10-22(21)26-29-31-32-30-26;;;;/h7-10,12-15H,5-6,11,16-17H2,1-4H3;;3*1H2/q-1;+1;;;
IUPAC Name
potassium 5-[4'-({2-butyl-5-[(dimethylcarbamothioyl)methyl]-4-methyl-6-oxo-1,6-dihydropyrimidin-1-yl}methyl)-[1,1'-biphenyl]-2-yl]-1H-1,2,3,4-tetrazol-1-ide trihydrate
SMILES
O.O.O.[K+].CCCCC1=NC(C)=C(CC(=S)N(C)C)C(=O)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=N[N-]1
ChemSpider
28497172
ChEMBL
CHEMBL1951146
Predicted Properties
PropertyValueSource
Water Solubility0.00542 mg/mLALOGPS
logP4.03ALOGPS
logP4.21Chemaxon
logS-5ALOGPS
pKa (Strongest Acidic)4.23Chemaxon
pKa (Strongest Basic)1.34Chemaxon
Physiological Charge-1Chemaxon
Hydrogen Acceptor Count6Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area87.47 Å2Chemaxon
Rotatable Bond Count9Chemaxon
Refractivity161.85 m3·mol-1Chemaxon
Polarizability54.61 Å3Chemaxon
Number of Rings4Chemaxon
Bioavailability1Chemaxon
Rule of FiveNoChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleYesChemaxon