Safinamide mesylateProduct ingredient for Safinamide
- Name
- Safinamide mesylate
- Drug Entry
- Safinamide
Safinamide is for the treatment of parkinson's disease. It was approved in Europe in February 2015, and in the United States on March 21, 2017.
- Accession Number
- DBSALT002034
- Structure
- Synonyms
- Safinamide mesilate / Safinamide mesylate
- External IDs
- FCE-28073 / NW 1015 / PNU 151774E / PNU-151774E
- UNII
- YS90V3DTX0
- CAS Number
- 202825-46-5
- Weight
- Average: 398.45
Monoisotopic: 398.131171186 - Chemical Formula
- C18H23FN2O5S
- InChI Key
- YKOCHIUQOBQIAC-YDALLXLXSA-N
- InChI
- InChI=1S/C17H19FN2O2.CH4O3S/c1-12(17(19)21)20-10-13-5-7-16(8-6-13)22-11-14-3-2-4-15(18)9-14;1-5(2,3)4/h2-9,12,20H,10-11H2,1H3,(H2,19,21);1H3,(H,2,3,4)/t12-;/m0./s1
- IUPAC Name
- (2S)-2-[({4-[(3-fluorophenyl)methoxy]phenyl}methyl)amino]propanamide; methanesulfonic acid
- SMILES
- CS(O)(=O)=O.C[C@H](NCC1=CC=C(OCC2=CC=CC(F)=C2)C=C1)C(N)=O
- External Links
- ChemSpider
- 2302066
- ChEMBL
- CHEMBL48582
- Predicted Properties
Property Value Source Water Solubility 0.00989 mg/mL ALOGPS logP 2.59 ALOGPS logP 2.48 Chemaxon logS -4.5 ALOGPS pKa (Strongest Acidic) 15.76 Chemaxon pKa (Strongest Basic) 7.93 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 3 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 64.35 Å2 Chemaxon Rotatable Bond Count 7 Chemaxon Refractivity 83 m3·mol-1 Chemaxon Polarizability 32.38 Å3 Chemaxon Number of Rings 2 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon