Home Sulfos Propanamide, 2-[[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]amino]-, (2S)-, methanesulfonate (1:1)

Propanamide, 2-[[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]amino]-, (2S)-, methanesulfonate (1:1)

CAS No.:
202825-46-5
Catalog Number:
AG0028G1
Molecular Formula:
C18H23FN2O5S
Molecular Weight:
398.4490
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
≥98%
1 week
United States
$125
- +
10mg
≥98%
1 week
United States
$186
- +
25mg
≥98%
1 week
United States
$364
- +
50mg
≥98%
1 week
United States
$636
- +
Product Description
Catalog Number:
AG0028G1
Chemical Name:
Propanamide, 2-[[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]amino]-, (2S)-, methanesulfonate (1:1)
CAS Number:
202825-46-5
Molecular Formula:
C18H23FN2O5S
Molecular Weight:
398.4490
MDL Number:
MFCD15145475
IUPAC Name:
(2S)-2-[[4-[(3-fluorophenyl)methoxy]phenyl]methylamino]propanamide;methanesulfonic acid
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
InChI Key:
YKOCHIUQOBQIAC-YDALLXLXSA-N
SMILES:
CS(=O)(=O)O.NC(=O)[C@@H](NCc1ccc(cc1)OCc1cccc(c1)F)C
EC Number:
606-485-0
UNII:
YS90V3DTX0
Properties
Complexity:
438  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
398.131g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
398.449g/mol
Monoisotopic Mass:
398.131g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
127A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
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The effect of safinamide, a novel drug for Parkinson's disease, on pressor response to oral tyramine: a randomized, double-blind, clinical trial. Clinical pharmacology and therapeutics 20121001
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An expert opinion on safinamide in Parkinson's disease. Expert opinion on investigational drugs 20080701
Monoamine oxidase-B inhibition in the treatment of Parkinson's disease. Pharmacotherapy 20071201
Structures of human monoamine oxidase B complexes with selective noncovalent inhibitors: safinamide and coumarin analogs. Journal of medicinal chemistry 20071115
Solid-phase synthesis and insights into structure-activity relationships of safinamide analogues as potent and selective inhibitors of type B monoamine oxidase. Journal of medicinal chemistry 20071004
Safinamide for the treatment of Parkinson's disease, epilepsy and restless legs syndrome. Current opinion in investigational drugs (London, England : 2000) 20070701
Safinamide. Neurotherapeutics : the journal of the American Society for Experimental NeuroTherapeutics 20070101
Safinamide: from molecular targets to a new anti-Parkinson drug. Neurology 20061010
Symptom relief in Parkinson disease by safinamide: Biochemical and clinical evidence of efficacy beyond MAO-B inhibition. Neurology 20061010
Bioassay of safinamide in biological fluids of humans and various animal species. Arzneimittel-Forschung 20060101
Improvement of motor function in early Parkinson disease by safinamide. Neurology 20040824
Pharmacokinetics and pharmacodynamics of safinamide, a neuroprotectant with antiparkinsonian and anticonvulsant activity. Pharmacological research 20040701
Safinamide: FCE 26743, NW 1015, PNU 151774, PNU 151774E. Drugs in R&D 20040101
Pressor response to intravenous tyramine in healthy subjects after safinamide, a novel neuroprotectant with selective, reversible monoamine oxidase B inhibition. Clinical neuropharmacology 20030101
Safinamide (Newron Pharmaceuticals). Current opinion in investigational drugs (London, England : 2000) 20010601
Properties