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Pramipexole 2HCl Monohydrate

CAT: 1568-C16584-01Size: 10 mM / 1 mLDry Ice: YesHazardous: No
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CAT#:1568-C16584-01Size:10 mM / 1 mL
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
191217-81-9
SKU
C16584-50mg
Target
Dopamine Receptor
Applications
Neuronal Signaling
Smiles
CCCNC1CCC2=C (C1) SC (=N2) N.O.Cl.Cl
Molecular Formula
C10H17N3S.2HCl.H2O
Additionnal Information
Pramipexole 2HCl Monohydrate is a novel non-ergoline dopamine (DA) agonist, used to treat Parkinson's disease.
Storage Conditions
2 years -80 in solvent

Chemical Information

Pramipexole Dihydrochloride Monohydrate

Pramipexole hydrochloride is a hydrate that is the monohydrate of the dihydrochloride salt of pramiprexole. It has a role as an antiparkinson drug and a dopamine agonist. It contains a member of pramipexole hydrochloride anhydrous and a pramipexole(2+).

CAS Number191217-81-9
PubChem CID166589
IUPAC Name(6S)-6-N-propyl-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine;hydrate;dihydrochloride
Molecular FormulaC10H21Cl2N3OS
Molecular Weight302.3
Topological Polar Surface Area80.2
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity188
SMILES
CCCN[C@H]1CCC2=C(C1)SC(=N2)N.O.Cl.Cl
InChI
InChI=1S/C10H17N3S.2ClH.H2O/c1-2-5-12-7-3-4-8-9(6-7)14-10(11)13-8;;;/h7,12H,2-6H2,1H3,(H2,11,13);2*1H;1H2/t7-;;;/m0.../s1
InChIKey
APVQOOKHDZVJEX-QTPLPEIMSA-N
Chemical Structure
2D Structure
2D structure of Pramipexole Dihydrochloride Monohydrate
CAS: 191217-81-9
CID: 166589
Formula: C10H21Cl2N3OS
MW: 302.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight302.3
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass301.0782389
Monoisotopic Mass301.0782389
Topological Polar Surface Area80.2 Ų
Heavy Atom Count17
Formal Charge0
Complexity188
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count4
Compound Is CanonicalizedYes