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Rotigotine-

CAT: 0013-GTR19168210-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19168210-03Size:10 mg
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Description
Rotigotine (N-0923) is a non-ergot dopamine agonist used to treat Parkinson's disease and restless legs syndrome via a transdermal patch. It is employed in neuroscience research to study dopaminergic pathways in both in vitro receptor binding assays and in vivo models of movement disorders, with no significant association with drug-induced liver injury.
CAS Number
99755-59-6
Product Name Alternative
5-HT1A, 5-HT Receptor, AdrenergicReceptor, Adrenergic Receptor, 5HTReceptor, 5-hydroxytryptamine Receptor, 5HT Receptor, D2, D3, dopamine, Dopamine, Dopamine Receptor, DopamineReceptor, Beta Receptor, Inhibitor, N 0437, N 0923, inhibit, N0437, N-0437, N0923, N-0923, Neupro, α2B-adrenergic, Rotigotine, Rotigotine-, SPM 962, SPM962, SPM-962, Serotonin Receptor, receptor
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Purity
98.08% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (6.34 mM) ; H2O:< 1 mg/mL (insoluble or slightly soluble) ; DMSO:75 mg/mL (237.74 mM) ; Ethanol:59 mg/mL (187.02 mM)
Smiles
OC1=C2C (C[C@@H] (N (CCC3=CC=CS3) CCC) CC2) =CC=C1
Molecular Formula
C19H25NOS
Molecular Weight
315.47
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Rotigotine

Rotigotine is a member of tetralins.

CAS Number99755-59-6
PubChem CID59227
IUPAC Name(6S)-6-[propyl(2-thiophen-2-ylethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
Molecular FormulaC19H25NOS
Molecular Weight315.5
XLogP4.9
Topological Polar Surface Area51.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count22
Formal Charge0
Complexity337
SMILES
CCCN(CCC1=CC=CS1)[C@H]2CCC3=C(C2)C=CC=C3O
InChI
InChI=1S/C19H25NOS/c1-2-11-20(12-10-17-6-4-13-22-17)16-8-9-18-15(14-16)5-3-7-19(18)21/h3-7,13,16,21H,2,8-12,14H2,1H3/t16-/m0/s1
InChIKey
KFQYTPMOWPVWEJ-INIZCTEOSA-N
Chemical Structure
2D Structure
2D structure of Rotigotine
CAS: 99755-59-6
CID: 59227
Formula: C19H25NOS
MW: 315.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight315.5
XLogP34.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass315.16568559
Monoisotopic Mass315.16568559
Topological Polar Surface Area51.7 Ų
Heavy Atom Count22
Formal Charge0
Complexity337
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T6647-01Rotigotine-
RM-R152000-01Rotigotine
A3777-100Rotigotine hydrochloride
HY-A0007-01Rotigotine (Hydrochloride)
HY-15394A-01(Rac) -Rotigotine

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